(4-bromanyl-3-methyl-phenyl)-[4-(phenylmethyl)-1,4-diazepan-1-yl]methanone

Systemtic Name: (4-bromanyl-3-methyl-phenyl)-[4-(phenylmethyl)-1,4-diazepan-1-yl]methanone Openeye Name: (4-benzyl-1,4-diazepan-1-yl)-(4-bromo-3-methyl-phenyl)methanone CAS Name: (4-bromo-3-methylphenyl)-[4-(phenylmethyl)-1,4-diazepan-1-yl]methanone IUPAC Name: (4-benzyl-1,4-diazepan-1-yl)-(4-bromo-3-methylphenyl)methanone Traditional Name: (4-benzyl-1,4-diazepan-1-yl)-(4-bromo-3-methyl-phenyl)methanone Formula: C20H23BrN2O MolecularWeight: 387.31342

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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