(4R,5S,6R)-1-(4-methoxyphenyl)-5,6-dimethyl-4-phenyl-azepan-2-one

Systemtic Name: (4R,5S,6R)-1-(4-methoxyphenyl)-5,6-dimethyl-4-phenyl-azepan-2-one Openeye Name: (4R,5S,6R)-1-(4-methoxyphenyl)-5,6-dimethyl-4-phenyl-azepan-2-one CAS Name: (4R,5S,6R)-1-(4-methoxyphenyl)-5,6-dimethyl-4-phenyl-2-azepanone IUPAC Name: (4R,5S,6R)-1-(4-methoxyphenyl)-5,6-dimethyl-4-phenylazepan-2-one Traditional Name: (4R,5S,6R)-1-(4-methoxyphenyl)-5,6-dimethyl-4-phenyl-azepan-2-one Formula: C21H25NO2 MolecularWeight: 323.4287

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(C(=O)CC(C1C)C2=CC=CC=C2)C3=CC=C(C=C3)OC

Isomeric SMILES

C[C@H]1CN(C(=O)C[C@H]([C@@H]1C)C2=CC=CC=C2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H25NO2/c1-15-14-22(18-9-11-19(24-3)12-10-18)21(23)13-20(16(15)2)17-7-5-4-6-8-17/h4-12,15-16,20H,13-14H2,1-3H3/t15-,16+,20+/m0/s1