1-[(3-bromophenyl)methylsulfonyl]-N-tert-butyl-piperidine-4-carboxamide

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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