RefChem:1056162

(E)-but-2-enedioic acid;2-(dimethylamino)ethyl 8-methyl-2-oxo-1-oxa-3-azaspiro[4.5]decane-3-carboxylate

Also Known As: Dimethylaminoethyl 8-methyl-2-oxo-1-oxa-3-azaspiro(4.5)decane-3-carboxylate fumarate, (E)-|1-Oxa-3-azaspiro(4.5)decane-3-carboxylic acid, 7-methyl-2-oxo-, 2-dimethylaminoethyl ester, fumarate, (Z)-|Dimethylaminoethyl 7-methyl-2-oxo-1-oxa-3-azaspiro(4.5)decane-3-carboxylate fumarate (Z)-|Methyl-7 oxa-1 oxo-2 aza-3 (dimethylamino ethoxy carbonyl)-3 spiro(4.5)decane fumarate, (Z)-|1-Oxa-3-azaspiro(4.5)decane-3-carboxylic acid, 8-methyl-2-oxo-, 2-dimethylaminoethyl ester, fumarate, (E)-|(E)-but-2-enedioic acid; 2-dimethylaminoethyl 8-methyl-3-oxo-4-oxa-2-azaspiro[4.5]decane-2-carboxylate|1-Oxa-3-azaspiro[4.5]decane-3-carboxylic acid, 8-methyl-2-oxo-, 2-(dimethylamino)ethyl ester, fumarate (1:1), trans-|1-Oxa-3-azaspiro[4.5]decane-3-carboxylic acid, 8-methyl-2-oxo-, 2-(dimethylamino)ethyl ester, trans-, (E)-2-butenedioate (1:1)

Molecular Formula	C18H28N2O8
Molecular Weight	400.18457 g/mol
LogP	1.7975
Topological Polar Surface Area	133.68 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	7
Rotatable Bonds	5
Exact Mass	400.18457
Monoisotopic Mass	400.18457
Heavy Atoms	28
Complexity	592.70685

Chemical Identifiers

CAS Number	72017-31-3
SMILES	CC1CCC2(CC1)CN(C(=O)O2)C(=O)OCCN(C)C.C(=C/C(=O)O)\C(=O)O