1-(4-bromophenyl)sulfonyl-N-(2-propoxyphenyl)piperidine-3-carboxamide

Systemtic Name: 1-(4-bromophenyl)sulfonyl-N-(2-propoxyphenyl)piperidine-3-carboxamide Openeye Name: 1-(4-bromophenyl)sulfonyl-N-(2-propoxyphenyl)piperidine-3-carboxamide CAS Name: 1-(4-bromophenyl)sulfonyl-N-(2-propoxyphenyl)-3-piperidinecarboxamide IUPAC Name: 1-(4-bromophenyl)sulfonyl-N-(2-propoxyphenyl)piperidine-3-carboxamide Traditional Name: 1-brosyl-N-(2-propoxyphenyl)nipecotamide Formula: C21H25BrN2O4S MolecularWeight: 481.4032

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC=C1NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CCCOC1=CC=CC=C1NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C21H25BrN2O4S/c1-2-14-28-20-8-4-3-7-19(20)23-21(25)16-6-5-13-24(15-16)29(26,27)18-11-9-17(22)10-12-18/h3-4,7-12,16H,2,5-6,13-15H2,1H3,(H,23,25)