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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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