[(E)-2-(7-oxidanylideneazepan-2-yl)ethenyl] benzoate

Systemtic Name: [(E)-2-(7-oxidanylideneazepan-2-yl)ethenyl] benzoate Openeye Name: [(E)-2-(7-oxoazepan-2-yl)vinyl] benzoate CAS Name: benzoic acid [(E)-2-(7-oxo-2-azepanyl)ethenyl] ester IUPAC Name: [(E)-2-(7-oxoazepan-2-yl)ethenyl] benzoate Traditional Name: benzoic acid [(E)-2-(7-ketoazepan-2-yl)vinyl] ester Formula: C15H17NO3 MolecularWeight: 259.30038

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)NC(C1)C=COC(=O)C2=CC=CC=C2

Isomeric SMILES

C1CCC(=O)NC(C1)/C=C/OC(=O)C2=CC=CC=C2

InChI

InChI=1S/C15H17NO3/c17-14-9-5-4-8-13(16-14)10-11-19-15(18)12-6-2-1-3-7-12/h1-3,6-7,10-11,13H,4-5,8-9H2,(H,16,17)/b11-10+