2-(2-oxidanylideneazepan-1-yl)ethyl 2-[3-(phenylcarbonyl)phenyl]propanoate

Systemtic Name: 2-(2-oxidanylideneazepan-1-yl)ethyl 2-[3-(phenylcarbonyl)phenyl]propanoate Openeye Name: 2-(2-oxoazepan-1-yl)ethyl 2-(3-benzoylphenyl)propanoate CAS Name: 2-(3-benzoylphenyl)propanoic acid 2-(2-oxo-1-azepanyl)ethyl ester IUPAC Name: 2-(2-oxoazepan-1-yl)ethyl 2-(3-benzoylphenyl)propanoate Traditional Name: 2-(3-benzoylphenyl)propionic acid 2-(2-ketoazepan-1-yl)ethyl ester Formula: C24H27NO4 MolecularWeight: 393.47548

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC(=C1)C(=O)C2=CC=CC=C2)C(=O)OCCN3CCCCCC3=O

Isomeric SMILES

CC(C1=CC=CC(=C1)C(=O)C2=CC=CC=C2)C(=O)OCCN3CCCCCC3=O

InChI

InChI=1S/C24H27NO4/c1-18(24(28)29-16-15-25-14-7-3-6-13-22(25)26)20-11-8-12-21(17-20)23(27)19-9-4-2-5-10-19/h2,4-5,8-12,17-18H,3,6-7,13-16H2,1H3