[2-[(1-cyanocyclopentyl)amino]-2-oxidanylidene-ethyl] 2-(4-acetamidophenyl)ethanoate

Systemtic Name: [2-[(1-cyanocyclopentyl)amino]-2-oxidanylidene-ethyl] 2-(4-acetamidophenyl)ethanoate Openeye Name: [2-[(1-cyanocyclopentyl)amino]-2-oxo-ethyl] 2-(4-acetamidophenyl)acetate CAS Name: 2-(4-acetamidophenyl)acetic acid [2-[(1-cyanocyclopentyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(1-cyanocyclopentyl)amino]-2-oxoethyl] 2-(4-acetamidophenyl)acetate Traditional Name: 2-(4-acetamidophenyl)acetic acid [2-[(1-cyanocyclopentyl)amino]-2-keto-ethyl] ester Formula: C18H21N3O4 MolecularWeight: 343.37704

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)CC(=O)OCC(=O)NC2(CCCC2)C#N

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)CC(=O)OCC(=O)NC2(CCCC2)C#N

InChI

InChI=1S/C18H21N3O4/c1-13(22)20-15-6-4-14(5-7-15)10-17(24)25-11-16(23)21-18(12-19)8-2-3-9-18/h4-7H,2-3,8-11H2,1H3,(H,20,22)(H,21,23)