AC1Q1NZL

2-[N-(2-cyanoethyl)-4-[(4-nitrophenyl)diazenyl]anilino]ethyl 2-methylpropanoate

Also Known As: 2-[[4-[azo]phenyl]amino]ethylisobutyrate|2-[ [4-[ azo]phenyl]amino]ethylisobutyrate|2-((2-Cyanoethyl)(4-((4-nitrophenyl)azo)phenyl)amino)ethyl isobutyrate|Propanoic acid, 2-methyl-, 2-((2-cyanoethyl)(4-((4-nitrophenyl)azo)phenyl)amino)ethyl ester|Propanoic acid, 2-methyl-, 2-((2-cyanoethyl)(4-(2-(4-nitrophenyl)diazenyl)phenyl)amino)ethyl ester|2-[N-(2-cyanoethyl)-4-[(4-nitrophenyl)diazenyl]anilino]ethyl 2-methylpropanoate|Propanoic acid, 2-methyl-, 2-[(2-cyanoethyl)[4-[(4-nitrophenyl)azo]phenyl]amino]ethyl ester|Propanoic acid, 2-methyl-, 2-[(2-cyanoethyl)[4-[2-(4-nitrophenyl)diazenyl]phenyl]amino]ethyl ester|2-[(2-cyanoethyl)({4-[2-(4-nitrophenyl)diazen-1-yl]phenyl})amino]ethyl 2-methylpropanoate|2-[(2-CYANOETHYL)[4-[(4-NITROPHENYL)AZO]PHENYL]AMINO]ETHYL ISOBUTYRATE|2-[(2-Cyanoethyl){4-[(4-nitrophenyl)diazenyl]phenyl}amino]ethyl 2-methylpropanoate|2-[2-cyanoethyl-[4-(4-nitrophenyl)diazenylphenyl]amino]ethyl 2-methylpropanoate|2-Methylpropanoic acid 2-[(2-cyanoethyl)[4-[(4-nitrophenyl)azo]phenyl]amino]ethyl ester|Propanoic acid,2-methyl-, 2-[(2-cyanoethyl)[4-[2-(4-nitrophenyl)diazenyl]phenyl]amino]ethylester

Molecular Formula	C21H23N5O4
Molecular Weight	409.17502 g/mol
LogP	4.3
Topological Polar Surface Area	124.0 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	8
Rotatable Bonds	10
Exact Mass	409.17502
Monoisotopic Mass	409.17502
Heavy Atoms	30
Complexity	623.0

Chemical Identifiers

CAS Number	75908-85-9
SMILES	CC(C)C(=O)OCCN(CCC#N)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)[N+](=O)[O-]
InChIKey	FUPDULJPZHOYCR-UHFFFAOYSA-N