[1-(4-fluorophenyl)carbonyl-2-oxidanylidene-azepan-3-yl] 2-(phenylcarbonyl)benzoate

Systemtic Name: [1-(4-fluorophenyl)carbonyl-2-oxidanylidene-azepan-3-yl] 2-(phenylcarbonyl)benzoate Openeye Name: [1-(4-fluorobenzoyl)-2-oxo-azepan-3-yl] 2-benzoylbenzoate CAS Name: 2-benzoylbenzoic acid [1-[(4-fluorophenyl)-oxomethyl]-2-oxo-3-azepanyl] ester IUPAC Name: [1-(4-fluorobenzoyl)-2-oxoazepan-3-yl] 2-benzoylbenzoate Traditional Name: 2-benzoylbenzoic acid [1-(4-fluorobenzoyl)-2-keto-azepan-3-yl] ester Formula: C27H22FNO5 MolecularWeight: 459.465683

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(=O)C(C1)OC(=O)C2=CC=CC=C2C(=O)C3=CC=CC=C3)C(=O)C4=CC=C(C=C4)F

Isomeric SMILES

C1CCN(C(=O)C(C1)OC(=O)C2=CC=CC=C2C(=O)C3=CC=CC=C3)C(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C27H22FNO5/c28-20-15-13-19(14-16-20)25(31)29-17-7-6-12-23(26(29)32)34-27(33)22-11-5-4-10-21(22)24(30)18-8-2-1-3-9-18/h1-5,8-11,13-16,23H,6-7,12,17H2