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

Systemtic Name: 3-(2-oxidanylideneazepan-1-yl)propyl 2-[3-(phenylcarbonyl)phenyl]propanoate Openeye Name: 3-(2-oxoazepan-1-yl)propyl 2-(3-benzoylphenyl)propanoate CAS Name: 2-(3-benzoylphenyl)propanoic acid 3-(2-oxo-1-azepanyl)propyl ester IUPAC Name: 3-(2-oxoazepan-1-yl)propyl 2-(3-benzoylphenyl)propanoate Traditional Name: 2-(3-benzoylphenyl)propionic acid 3-(2-ketoazepan-1-yl)propyl ester Formula: C25H29NO4 MolecularWeight: 407.50206

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC(=C1)C(=O)C2=CC=CC=C2)C(=O)OCCCN3CCCCCC3=O

Isomeric SMILES

CC(C1=CC=CC(=C1)C(=O)C2=CC=CC=C2)C(=O)OCCCN3CCCCCC3=O

InChI

InChI=1S/C25H29NO4/c1-19(25(29)30-17-9-16-26-15-7-3-6-14-23(26)27)21-12-8-13-22(18-21)24(28)20-10-4-2-5-11-20/h2,4-5,8,10-13,18-19H,3,6-7,9,14-17H2,1H3