1-[2-(2,2-diphenylethyl)azepin-1-yl]-3-(3,4,5-trimethoxyphenyl)propan-1-one

Systemtic Name: 1-[2-(2,2-diphenylethyl)azepin-1-yl]-3-(3,4,5-trimethoxyphenyl)propan-1-one Openeye Name: 1-[2-(2,2-diphenylethyl)azepin-1-yl]-3-(3,4,5-trimethoxyphenyl)propan-1-one CAS Name: 1-[2-(2,2-diphenylethyl)-1-azepinyl]-3-(3,4,5-trimethoxyphenyl)-1-propanone IUPAC Name: 1-[2-(2,2-diphenylethyl)azepin-1-yl]-3-(3,4,5-trimethoxyphenyl)propan-1-one Traditional Name: 1-[2-(2,2-diphenylethyl)azepin-1-yl]-3-(3,4,5-trimethoxyphenyl)propan-1-one Formula: C32H33NO4 MolecularWeight: 495.60872

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CCC(=O)N2C=CC=CC=C2CC(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CCC(=O)N2C=CC=CC=C2CC(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C32H33NO4/c1-35-29-21-24(22-30(36-2)32(29)37-3)18-19-31(34)33-20-12-6-11-17-27(33)23-28(25-13-7-4-8-14-25)26-15-9-5-10-16-26/h4-17,20-22,28H,18-19,23H2,1-3H3