[2-[(1-cyanocyclopentyl)amino]-2-oxidanylidene-ethyl] 2-[(phenylmethyl)carbamoylamino]ethanoate

Systemtic Name: [2-[(1-cyanocyclopentyl)amino]-2-oxidanylidene-ethyl] 2-[(phenylmethyl)carbamoylamino]ethanoate Openeye Name: [2-[(1-cyanocyclopentyl)amino]-2-oxo-ethyl] 2-(benzylcarbamoylamino)acetate CAS Name: 2-[[oxo-[(phenylmethyl)amino]methyl]amino]acetic acid [2-[(1-cyanocyclopentyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(1-cyanocyclopentyl)amino]-2-oxoethyl] 2-(benzylcarbamoylamino)acetate Traditional Name: 2-(benzylcarbamoylamino)acetic acid [2-[(1-cyanocyclopentyl)amino]-2-keto-ethyl] ester Formula: C18H22N4O4 MolecularWeight: 358.39168

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)(C#N)NC(=O)COC(=O)CNC(=O)NCC2=CC=CC=C2

Isomeric SMILES

C1CCC(C1)(C#N)NC(=O)COC(=O)CNC(=O)NCC2=CC=CC=C2

InChI

InChI=1S/C18H22N4O4/c19-13-18(8-4-5-9-18)22-15(23)12-26-16(24)11-21-17(25)20-10-14-6-2-1-3-7-14/h1-3,6-7H,4-5,8-12H2,(H,22,23)(H2,20,21,25)