[2-(azepan-1-yl)-2-oxidanylidene-ethyl] 2-(4-phenylphenyl)ethanoate

Systemtic Name: [2-(azepan-1-yl)-2-oxidanylidene-ethyl] 2-(4-phenylphenyl)ethanoate Openeye Name: [2-(azepan-1-yl)-2-oxo-ethyl] 2-(4-phenylphenyl)acetate CAS Name: 2-(4-phenylphenyl)acetic acid [2-(1-azepanyl)-2-oxoethyl] ester IUPAC Name: [2-(azepan-1-yl)-2-oxoethyl] 2-(4-phenylphenyl)acetate Traditional Name: 2-(4-phenylphenyl)acetic acid [2-(azepan-1-yl)-2-keto-ethyl] ester Formula: C22H25NO3 MolecularWeight: 351.4388

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)COC(=O)CC2=CC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

C1CCCN(CC1)C(=O)COC(=O)CC2=CC=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H25NO3/c24-21(23-14-6-1-2-7-15-23)17-26-22(25)16-18-10-12-20(13-11-18)19-8-4-3-5-9-19/h3-5,8-13H,1-2,6-7,14-17H2