1-(4-bromophenyl)sulfonyl-N-methyl-N-[(2-methylphenyl)methyl]piperidine-3-carboxamide

Systemtic Name: 1-(4-bromophenyl)sulfonyl-N-methyl-N-[(2-methylphenyl)methyl]piperidine-3-carboxamide Openeye Name: 1-(4-bromophenyl)sulfonyl-N-methyl-N-(o-tolylmethyl)piperidine-3-carboxamide CAS Name: 1-(4-bromophenyl)sulfonyl-N-methyl-N-[(2-methylphenyl)methyl]-3-piperidinecarboxamide IUPAC Name: 1-(4-bromophenyl)sulfonyl-N-methyl-N-[(2-methylphenyl)methyl]piperidine-3-carboxamide Traditional Name: 1-brosyl-N-methyl-N-(2-methylbenzyl)nipecotamide Formula: C21H25BrN2O3S MolecularWeight: 465.4038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN(C)C(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CC1=CC=CC=C1CN(C)C(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C21H25BrN2O3S/c1-16-6-3-4-7-17(16)14-23(2)21(25)18-8-5-13-24(15-18)28(26,27)20-11-9-19(22)10-12-20/h3-4,6-7,9-12,18H,5,8,13-15H2,1-2H3