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

Systemtic Name: (3-bromophenyl)-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]methanone Openeye Name: (3-bromophenyl)-[4-(p-tolylmethyl)-1,4-diazepan-1-yl]methanone CAS Name: (3-bromophenyl)-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]methanone IUPAC Name: (3-bromophenyl)-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]methanone Traditional Name: (3-bromophenyl)-[4-(4-methylbenzyl)-1,4-diazepan-1-yl]methanone Formula: C20H23BrN2O MolecularWeight: 387.31342

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23BrN2O/c1-16-6-8-17(9-7-16)15-22-10-3-11-23(13-12-22)20(24)18-4-2-5-19(21)14-18/h2,4-9,14H,3,10-13,15H2,1H3