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

Systemtic Name: [2-[(1-cyanocyclopentyl)amino]-2-oxidanylidene-ethyl] 4-[(4-chlorophenyl)carbonylamino]butanoate Openeye Name: [2-[(1-cyanocyclopentyl)amino]-2-oxo-ethyl] 4-[(4-chlorobenzoyl)amino]butanoate CAS Name: 4-[[(4-chlorophenyl)-oxomethyl]amino]butanoic acid [2-[(1-cyanocyclopentyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(1-cyanocyclopentyl)amino]-2-oxoethyl] 4-[(4-chlorobenzoyl)amino]butanoate Traditional Name: 4-[(4-chlorobenzoyl)amino]butyric acid [2-[(1-cyanocyclopentyl)amino]-2-keto-ethyl] ester Formula: C19H22ClN3O4 MolecularWeight: 391.84868

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)(C#N)NC(=O)COC(=O)CCCNC(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

C1CCC(C1)(C#N)NC(=O)COC(=O)CCCNC(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C19H22ClN3O4/c20-15-7-5-14(6-8-15)18(26)22-11-3-4-17(25)27-12-16(24)23-19(13-21)9-1-2-10-19/h5-8H,1-4,9-12H2,(H,22,26)(H,23,24)