[4-[(3,4-dimethylphenyl)methyl]-1,4-diazepan-1-yl]-(4-methylphenyl)methanone

Systemtic Name: [4-[(3,4-dimethylphenyl)methyl]-1,4-diazepan-1-yl]-(4-methylphenyl)methanone Openeye Name: [4-[(3,4-dimethylphenyl)methyl]-1,4-diazepan-1-yl]-(p-tolyl)methanone CAS Name: [4-[(3,4-dimethylphenyl)methyl]-1,4-diazepan-1-yl]-(4-methylphenyl)methanone IUPAC Name: [4-[(3,4-dimethylphenyl)methyl]-1,4-diazepan-1-yl]-(4-methylphenyl)methanone Traditional Name: [4-(3,4-dimethylbenzyl)-1,4-diazepan-1-yl]-(p-tolyl)methanone Formula: C22H28N2O MolecularWeight: 336.47052

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CCCN(CC2)CC3=CC(=C(C=C3)C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CCCN(CC2)CC3=CC(=C(C=C3)C)C

InChI

InChI=1S/C22H28N2O/c1-17-5-9-21(10-6-17)22(25)24-12-4-11-23(13-14-24)16-20-8-7-18(2)19(3)15-20/h5-10,15H,4,11-14,16H2,1-3H3