N-(4-bromanyl-2-chloranyl-phenyl)-1-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperidine-4-carboxamide

Systemtic Name: N-(4-bromanyl-2-chloranyl-phenyl)-1-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperidine-4-carboxamide Openeye Name: N-(4-bromo-2-chloro-phenyl)-1-indan-5-ylsulfonyl-piperidine-4-carboxamide CAS Name: N-(4-bromo-2-chlorophenyl)-1-(2,3-dihydro-1H-inden-5-ylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-(4-bromo-2-chlorophenyl)-1-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperidine-4-carboxamide Traditional Name: N-(4-bromo-2-chloro-phenyl)-1-indan-5-ylsulfonyl-isonipecotamide Formula: C21H22BrClN2O3S MolecularWeight: 497.83298

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)S(=O)(=O)N3CCC(CC3)C(=O)NC4=C(C=C(C=C4)Br)Cl

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)S(=O)(=O)N3CCC(CC3)C(=O)NC4=C(C=C(C=C4)Br)Cl

InChI

InChI=1S/C21H22BrClN2O3S/c22-17-5-7-20(19(23)13-17)24-21(26)15-8-10-25(11-9-15)29(27,28)18-6-4-14-2-1-3-16(14)12-18/h4-7,12-13,15H,1-3,8-11H2,(H,24,26)