(phenylmethyl) 2-(3-acetamido-2-oxidanylidene-azepan-1-yl)ethanoate

Systemtic Name: (phenylmethyl) 2-(3-acetamido-2-oxidanylidene-azepan-1-yl)ethanoate Openeye Name: benzyl 2-(3-acetamido-2-oxo-azepan-1-yl)acetate CAS Name: 2-(3-acetamido-2-oxo-1-azepanyl)acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-(3-acetamido-2-oxoazepan-1-yl)acetate Traditional Name: 2-(3-acetamido-2-keto-azepan-1-yl)acetic acid benzyl ester Formula: C17H22N2O4 MolecularWeight: 318.36758

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1CCCCN(C1=O)CC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(=O)NC1CCCCN(C1=O)CC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C17H22N2O4/c1-13(20)18-15-9-5-6-10-19(17(15)22)11-16(21)23-12-14-7-3-2-4-8-14/h2-4,7-8,15H,5-6,9-12H2,1H3,(H,18,20)