[2-[bis(2-cyanoethyl)amino]-2-oxidanylidene-ethyl] 1-(4-ethylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: [2-[bis(2-cyanoethyl)amino]-2-oxidanylidene-ethyl] 1-(4-ethylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: [2-[bis(2-cyanoethyl)amino]-2-oxo-ethyl] 1-(4-ethylphenyl)-5-oxo-pyrrolidine-3-carboxylate CAS Name: 1-(4-ethylphenyl)-5-oxo-3-pyrrolidinecarboxylic acid [2-[bis(2-cyanoethyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[bis(2-cyanoethyl)amino]-2-oxoethyl] 1-(4-ethylphenyl)-5-oxopyrrolidine-3-carboxylate Traditional Name: 1-(4-ethylphenyl)-5-keto-pyrrolidine-3-carboxylic acid [2-[bis(2-cyanoethyl)amino]-2-keto-ethyl] ester Formula: C21H24N4O4 MolecularWeight: 396.43966

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2CC(CC2=O)C(=O)OCC(=O)N(CCC#N)CCC#N

Isomeric SMILES

CCC1=CC=C(C=C1)N2CC(CC2=O)C(=O)OCC(=O)N(CCC#N)CCC#N

InChI

InChI=1S/C21H24N4O4/c1-2-16-5-7-18(8-6-16)25-14-17(13-19(25)26)21(28)29-15-20(27)24(11-3-9-22)12-4-10-23/h5-8,17H,2-4,11-15H2,1H3