[2-[(1-cyanocyclopentyl)amino]-2-oxidanylidene-ethyl] 4-(4-bromophenyl)-4-oxidanylidene-butanoate

Systemtic Name: [2-[(1-cyanocyclopentyl)amino]-2-oxidanylidene-ethyl] 4-(4-bromophenyl)-4-oxidanylidene-butanoate Openeye Name: [2-[(1-cyanocyclopentyl)amino]-2-oxo-ethyl] 4-(4-bromophenyl)-4-oxo-butanoate CAS Name: 4-(4-bromophenyl)-4-oxobutanoic acid [2-[(1-cyanocyclopentyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(1-cyanocyclopentyl)amino]-2-oxoethyl] 4-(4-bromophenyl)-4-oxobutanoate Traditional Name: 4-(4-bromophenyl)-4-keto-butyric acid [2-[(1-cyanocyclopentyl)amino]-2-keto-ethyl] ester Formula: C18H19BrN2O4 MolecularWeight: 407.25846

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)(C#N)NC(=O)COC(=O)CCC(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

C1CCC(C1)(C#N)NC(=O)COC(=O)CCC(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C18H19BrN2O4/c19-14-5-3-13(4-6-14)15(22)7-8-17(24)25-11-16(23)21-18(12-20)9-1-2-10-18/h3-6H,1-2,7-11H2,(H,21,23)