1-[(3-bromophenyl)methylsulfonyl]-N-butan-2-yl-piperidine-4-carboxamide

Systemtic Name: 1-[(3-bromophenyl)methylsulfonyl]-N-butan-2-yl-piperidine-4-carboxamide Openeye Name: 1-[(3-bromophenyl)methylsulfonyl]-N-sec-butyl-piperidine-4-carboxamide CAS Name: 1-[(3-bromophenyl)methylsulfonyl]-N-butan-2-yl-4-piperidinecarboxamide IUPAC Name: 1-[(3-bromophenyl)methylsulfonyl]-N-butan-2-ylpiperidine-4-carboxamide Traditional Name: 1-(3-bromobenzyl)sulfonyl-N-sec-butyl-isonipecotamide Formula: C17H25BrN2O3S MolecularWeight: 417.361

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1CCN(CC1)S(=O)(=O)CC2=CC(=CC=C2)Br

Isomeric SMILES

CCC(C)NC(=O)C1CCN(CC1)S(=O)(=O)CC2=CC(=CC=C2)Br

InChI

InChI=1S/C17H25BrN2O3S/c1-3-13(2)19-17(21)15-7-9-20(10-8-15)24(22,23)12-14-5-4-6-16(18)11-14/h4-6,11,13,15H,3,7-10,12H2,1-2H3,(H,19,21)