N-[2-chloranyl-5-(trifluoromethyl)phenyl]-1-(4-methylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[2-chloranyl-5-(trifluoromethyl)phenyl]-1-(4-methylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[2-chloro-5-(trifluoromethyl)phenyl]-1-(p-tolylsulfonyl)piperidine-4-carboxamide CAS Name: N-[2-chloro-5-(trifluoromethyl)phenyl]-1-(4-methylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[2-chloro-5-(trifluoromethyl)phenyl]-1-(4-methylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[2-chloro-5-(trifluoromethyl)phenyl]-1-tosyl-isonipecotamide Formula: C20H20ClF3N2O3S MolecularWeight: 460.89761

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=C(C=CC(=C3)C(F)(F)F)Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=C(C=CC(=C3)C(F)(F)F)Cl

InChI

InChI=1S/C20H20ClF3N2O3S/c1-13-2-5-16(6-3-13)30(28,29)26-10-8-14(9-11-26)19(27)25-18-12-15(20(22,23)24)4-7-17(18)21/h2-7,12,14H,8-11H2,1H3,(H,25,27)