1-[(3-bromophenyl)methylsulfonyl]-N-[1-(4-methylphenyl)ethyl]piperidine-4-carboxamide

Systemtic Name: 1-[(3-bromophenyl)methylsulfonyl]-N-[1-(4-methylphenyl)ethyl]piperidine-4-carboxamide Openeye Name: 1-[(3-bromophenyl)methylsulfonyl]-N-[1-(p-tolyl)ethyl]piperidine-4-carboxamide CAS Name: 1-[(3-bromophenyl)methylsulfonyl]-N-[1-(4-methylphenyl)ethyl]-4-piperidinecarboxamide IUPAC Name: 1-[(3-bromophenyl)methylsulfonyl]-N-[1-(4-methylphenyl)ethyl]piperidine-4-carboxamide Traditional Name: 1-(3-bromobenzyl)sulfonyl-N-[1-(p-tolyl)ethyl]isonipecotamide Formula: C22H27BrN2O3S MolecularWeight: 479.43038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C)NC(=O)C2CCN(CC2)S(=O)(=O)CC3=CC(=CC=C3)Br

Isomeric SMILES

CC1=CC=C(C=C1)C(C)NC(=O)C2CCN(CC2)S(=O)(=O)CC3=CC(=CC=C3)Br

InChI

InChI=1S/C22H27BrN2O3S/c1-16-6-8-19(9-7-16)17(2)24-22(26)20-10-12-25(13-11-20)29(27,28)15-18-4-3-5-21(23)14-18/h3-9,14,17,20H,10-13,15H2,1-2H3,(H,24,26)