1-[4-(3,5-dimethylphenyl)carbonyl-5-phenyl-1,4-diazepan-1-yl]ethanone

Systemtic Name: 1-[4-(3,5-dimethylphenyl)carbonyl-5-phenyl-1,4-diazepan-1-yl]ethanone Openeye Name: 1-[4-(3,5-dimethylbenzoyl)-5-phenyl-1,4-diazepan-1-yl]ethanone CAS Name: 1-[4-[(3,5-dimethylphenyl)-oxomethyl]-5-phenyl-1,4-diazepan-1-yl]ethanone IUPAC Name: 1-[4-(3,5-dimethylbenzoyl)-5-phenyl-1,4-diazepan-1-yl]ethanone Traditional Name: 1-[4-(3,5-dimethylbenzoyl)-5-phenyl-1,4-diazepan-1-yl]ethanone Formula: C22H26N2O2 MolecularWeight: 350.45404

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(=O)N2CCN(CCC2C3=CC=CC=C3)C(=O)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)C(=O)N2CCN(CCC2C3=CC=CC=C3)C(=O)C)C

InChI

InChI=1S/C22H26N2O2/c1-16-13-17(2)15-20(14-16)22(26)24-12-11-23(18(3)25)10-9-21(24)19-7-5-4-6-8-19/h4-8,13-15,21H,9-12H2,1-3H3