3-ethyl-3-(3-phenylmethoxyphenyl)azepan-2-one

Systemtic Name: 3-ethyl-3-(3-phenylmethoxyphenyl)azepan-2-one Openeye Name: 3-(3-benzyloxyphenyl)-3-ethyl-azepan-2-one CAS Name: 3-ethyl-3-(3-phenylmethoxyphenyl)-2-azepanone IUPAC Name: 3-ethyl-3-(3-phenylmethoxyphenyl)azepan-2-one Traditional Name: 3-(3-benzoxyphenyl)-3-ethyl-azepan-2-one Formula: C21H25NO2 MolecularWeight: 323.4287

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CCCCNC1=O)C2=CC(=CC=C2)OCC3=CC=CC=C3

Isomeric SMILES

CCC1(CCCCNC1=O)C2=CC(=CC=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C21H25NO2/c1-2-21(13-6-7-14-22-20(21)23)18-11-8-12-19(15-18)24-16-17-9-4-3-5-10-17/h3-5,8-12,15H,2,6-7,13-14,16H2,1H3,(H,22,23)