RefChem:95814

azane;2-[(16-ethoxycarbonyl-14-methyl-8,15-dioxo-14-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2,4,6,9,11,13(17)-heptaen-10-yl)amino]-5-methylbenzenesulfonic acid

Also Known As: EINECS 263-958-0|Sodium spiro(2,2,5-trimethylcyclopentane barbiturate)|Sodium 1,1,4-trimethyl-7,9-diazaspiro(4.5)decane-6,8,10-trione|3H-Dibenz(f,ij)isoquinoline-1-carboxylic acid, 2,7-dihydro-3-methyl-6-((4-methyl-2-sulfophenyl)amino)-2,7-dioxo-, 1-ethyl ester, monoammonium salt|3H-Naphtho(1,2,3-de)quinoline-1-carboxylic acid, 2,7-dihydro-3-methyl-6-((4-methyl-2-sulfophenyl)amino)-2,7-dioxo-, 1-ethyl ester, ammonium salt (1:1)|3H-Naphtho(1,2,3-de)quinoline-1-carboxylic acid, 2,7-dihydro-3-methyl-6-((4-methyl-2-sulfophenyl)amino)-2,7-dioxo-, 1-ethyl ester, monoammonium salt|7,9-Diazaspiro(4.5)decane-6,8,10-trione, 1,1,4-trimethyl-, sodium salt|Ammonium 1-ethyl 2,7-dihydro-3-methyl-6-((4-methyl-2-sulphonatophenyl)amino)-2,7-dioxo-3H-dibenz(f,ij)isoquinoline-1-carboxylate|ammonium 2-{[1-(ethoxycarbonyl)-3-methyl-2,7-dioxo-2,7-dihydro-3h-naphtho[1,2,3-de]quinolin-6-yl]amino}-5-methylbenzenesulfonate|Sodium spiro(2',2',5'-trimethylcyclopentane)-5,5-pyrimidine-2,4,6-trione|7,9-Diazaspiro[4.5]decane-6,8,10-trione, 1,1,4-trimethyl-, monosodium salt|2-{[1-(Ethoxycarbonyl)-3-methyl-2,7-dioxo-2,7-dihydro-3H-naphtho[1,2,3-de]quinolin-6-yl]amino}-5-methylbenzene-1-sulfonic acid--ammonia (1/1)|3H-Dibenz[f,ij]isoquinoline-1-carboxylic acid, 2,7-dihydro-3-methyl-6-[(4-methyl-2-sulfophenyl)amino]-2,7-dioxo-, 1-ethyl ester, monoammonium salt|3H-Naphtho[1,2,3-de]quinoline-1-carboxylic acid, 2,7-dihydro-3-methyl-6-[(4-methyl-2-sulfophenyl)amino]-2,7-dioxo-, 1-ethyl ester, ammonium salt (1:1)|Ammonium 1-ethyl 2,7-dihydro-3-methyl-6-[(4-methyl-2-sulphonatophenyl)amino]-2,7-dioxo-3H-dibenz[f,ij]isoquinoline-1-carboxylate

Molecular Formula	C27H25N3O7S
Molecular Weight	535.1413 g/mol
LogP	4.39
Topological Polar Surface Area	166.77 Ų
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	9
Rotatable Bonds	5
Exact Mass	535.1413
Heavy Atoms	38
Complexity	1825.2

Chemical Identifiers

CAS Number	63149-14-4
SMILES	CCOC(=O)C1=C2C3=CC=CC=C3C(=O)C4=C(C=CC(=C42)N(C1=O)C)NC5=C(C=C(C=C5)C)S(=O)(=O)O.N