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

Systemtic Name: (3,4-dimethoxyphenyl)-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]methanone Openeye Name: (3,4-dimethoxyphenyl)-[4-(p-tolylmethyl)-1,4-diazepan-1-yl]methanone CAS Name: (3,4-dimethoxyphenyl)-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]methanone IUPAC Name: (3,4-dimethoxyphenyl)-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]methanone Traditional Name: (3,4-dimethoxyphenyl)-[4-(4-methylbenzyl)-1,4-diazepan-1-yl]methanone Formula: C22H28N2O3 MolecularWeight: 368.46932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2CCCN(CC2)C(=O)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)CN2CCCN(CC2)C(=O)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C22H28N2O3/c1-17-5-7-18(8-6-17)16-23-11-4-12-24(14-13-23)22(25)19-9-10-20(26-2)21(15-19)27-3/h5-10,15H,4,11-14,16H2,1-3H3