(phenylmethyl) 3-oxidanylideneazepane-1-carboxylate

Systemtic Name: (phenylmethyl) 3-oxidanylideneazepane-1-carboxylate Openeye Name: benzyl 3-oxoazepane-1-carboxylate CAS Name: 3-oxo-1-azepanecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 3-oxoazepane-1-carboxylate Traditional Name: 3-ketoazepane-1-carboxylic acid benzyl ester Formula: C14H17NO3 MolecularWeight: 247.28968

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC(=O)C1)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

C1CCN(CC(=O)C1)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C14H17NO3/c16-13-8-4-5-9-15(10-13)14(17)18-11-12-6-2-1-3-7-12/h1-3,6-7H,4-5,8-11H2