1-[(3-bromophenyl)methyl]-N-[(3-methylphenyl)-phenyl-methyl]piperidine-3-carboxamide

Systemtic Name: 1-[(3-bromophenyl)methyl]-N-[(3-methylphenyl)-phenyl-methyl]piperidine-3-carboxamide Openeye Name: 1-[(3-bromophenyl)methyl]-N-[m-tolyl(phenyl)methyl]piperidine-3-carboxamide CAS Name: 1-[(3-bromophenyl)methyl]-N-[(3-methylphenyl)-phenylmethyl]-3-piperidinecarboxamide IUPAC Name: 1-[(3-bromophenyl)methyl]-N-[(3-methylphenyl)-phenylmethyl]piperidine-3-carboxamide Traditional Name: 1-(3-bromobenzyl)-N-[m-tolyl(phenyl)methyl]nipecotamide Formula: C27H29BrN2O MolecularWeight: 477.43596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C(C2=CC=CC=C2)NC(=O)C3CCCN(C3)CC4=CC(=CC=C4)Br

Isomeric SMILES

CC1=CC(=CC=C1)C(C2=CC=CC=C2)NC(=O)C3CCCN(C3)CC4=CC(=CC=C4)Br

InChI

InChI=1S/C27H29BrN2O/c1-20-8-5-12-23(16-20)26(22-10-3-2-4-11-22)29-27(31)24-13-7-15-30(19-24)18-21-9-6-14-25(28)17-21/h2-6,8-12,14,16-17,24,26H,7,13,15,18-19H2,1H3,(H,29,31)