(phenylmethyl) 3-methanoylazepane-1-carboxylate

Systemtic Name: (phenylmethyl) 3-methanoylazepane-1-carboxylate Openeye Name: benzyl 3-formylazepane-1-carboxylate CAS Name: 3-formyl-1-azepanecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 3-formylazepane-1-carboxylate Traditional Name: 3-formylazepane-1-carboxylic acid benzyl ester Formula: C15H19NO3 MolecularWeight: 261.31626

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19NO3/c17-11-14-8-4-5-9-16(10-14)15(18)19-12-13-6-2-1-3-7-13/h1-3,6-7,11,14H,4-5,8-10,12H2