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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC(=C(C=C2Cl)Cl)Cl)S(=O)(=O)CCCC3=CC=CC=C3

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC(=C(C=C2Cl)Cl)Cl)S(=O)(=O)CCCC3=CC=CC=C3

InChI

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