N-[4-chloranyl-2-(trifluoromethyl)phenyl]-1-(3-phenylpropylsulfonyl)piperidine-4-carboxamide

Systemtic Name: N-[4-chloranyl-2-(trifluoromethyl)phenyl]-1-(3-phenylpropylsulfonyl)piperidine-4-carboxamide Openeye Name: N-[4-chloro-2-(trifluoromethyl)phenyl]-1-(3-phenylpropylsulfonyl)piperidine-4-carboxamide CAS Name: N-[4-chloro-2-(trifluoromethyl)phenyl]-1-(3-phenylpropylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-[4-chloro-2-(trifluoromethyl)phenyl]-1-(3-phenylpropylsulfonyl)piperidine-4-carboxamide Traditional Name: N-[4-chloro-2-(trifluoromethyl)phenyl]-1-(3-phenylpropylsulfonyl)isonipecotamide Formula: C22H24ClF3N2O3S MolecularWeight: 488.95077

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=C(C=C(C=C2)Cl)C(F)(F)F)S(=O)(=O)CCCC3=CC=CC=C3

Isomeric SMILES

C1CN(CCC1C(=O)NC2=C(C=C(C=C2)Cl)C(F)(F)F)S(=O)(=O)CCCC3=CC=CC=C3

InChI

InChI=1S/C22H24ClF3N2O3S/c23-18-8-9-20(19(15-18)22(24,25)26)27-21(29)17-10-12-28(13-11-17)32(30,31)14-4-7-16-5-2-1-3-6-16/h1-3,5-6,8-9,15,17H,4,7,10-14H2,(H,27,29)