1-(3-phenylpropylsulfonyl)-N-[2,4,5-tris(chloranyl)phenyl]piperidine-3-carboxamide

Systemtic Name: 1-(3-phenylpropylsulfonyl)-N-[2,4,5-tris(chloranyl)phenyl]piperidine-3-carboxamide Openeye Name: 1-(3-phenylpropylsulfonyl)-N-(2,4,5-trichlorophenyl)piperidine-3-carboxamide CAS Name: 1-(3-phenylpropylsulfonyl)-N-(2,4,5-trichlorophenyl)-3-piperidinecarboxamide IUPAC Name: 1-(3-phenylpropylsulfonyl)-N-(2,4,5-trichlorophenyl)piperidine-3-carboxamide Traditional Name: 1-(3-phenylpropylsulfonyl)-N-(2,4,5-trichlorophenyl)nipecotamide Formula: C21H23Cl3N2O3S MolecularWeight: 489.84292

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)CCCC2=CC=CC=C2)C(=O)NC3=CC(=C(C=C3Cl)Cl)Cl

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)CCCC2=CC=CC=C2)C(=O)NC3=CC(=C(C=C3Cl)Cl)Cl

InChI

InChI=1S/C21H23Cl3N2O3S/c22-17-12-19(24)20(13-18(17)23)25-21(27)16-9-4-10-26(14-16)30(28,29)11-5-8-15-6-2-1-3-7-15/h1-3,6-7,12-13,16H,4-5,8-11,14H2,(H,25,27)