ethyl 6-oxidanylidene-1-(phenylmethyl)azepane-4-carboxylate

Systemtic Name: ethyl 6-oxidanylidene-1-(phenylmethyl)azepane-4-carboxylate Openeye Name: ethyl 1-benzyl-6-oxo-azepane-4-carboxylate CAS Name: 6-oxo-1-(phenylmethyl)-4-azepanecarboxylic acid ethyl ester IUPAC Name: ethyl 1-benzyl-6-oxoazepane-4-carboxylate Traditional Name: 1-benzyl-6-keto-azepane-4-carboxylic acid ethyl ester Formula: C16H21NO3 MolecularWeight: 275.34284

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC(=O)C1)CC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1CCN(CC(=O)C1)CC2=CC=CC=C2

InChI

InChI=1S/C16H21NO3/c1-2-20-16(19)14-8-9-17(12-15(18)10-14)11-13-6-4-3-5-7-13/h3-7,14H,2,8-12H2,1H3