1-(4-bromophenyl)sulfonyl-N-(4-methyl-2-oxidanyl-phenyl)piperidine-3-carboxamide

Systemtic Name: 1-(4-bromophenyl)sulfonyl-N-(4-methyl-2-oxidanyl-phenyl)piperidine-3-carboxamide Openeye Name: 1-(4-bromophenyl)sulfonyl-N-(2-hydroxy-4-methyl-phenyl)piperidine-3-carboxamide CAS Name: 1-(4-bromophenyl)sulfonyl-N-(2-hydroxy-4-methylphenyl)-3-piperidinecarboxamide IUPAC Name: 1-(4-bromophenyl)sulfonyl-N-(2-hydroxy-4-methylphenyl)piperidine-3-carboxamide Traditional Name: 1-brosyl-N-(2-hydroxy-4-methyl-phenyl)nipecotamide Formula: C19H21BrN2O4S MolecularWeight: 453.35004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)Br)O

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)Br)O

InChI

InChI=1S/C19H21BrN2O4S/c1-13-4-9-17(18(23)11-13)21-19(24)14-3-2-10-22(12-14)27(25,26)16-7-5-15(20)6-8-16/h4-9,11,14,23H,2-3,10,12H2,1H3,(H,21,24)