N-[4-[bis(fluoranyl)methylsulfonyl]phenyl]-1-(4-methylphenyl)carbonyl-piperidine-3-carboxamide

Systemtic Name: N-[4-[bis(fluoranyl)methylsulfonyl]phenyl]-1-(4-methylphenyl)carbonyl-piperidine-3-carboxamide Openeye Name: N-[4-(difluoromethylsulfonyl)phenyl]-1-(4-methylbenzoyl)piperidine-3-carboxamide CAS Name: N-[4-(difluoromethylsulfonyl)phenyl]-1-[(4-methylphenyl)-oxomethyl]-3-piperidinecarboxamide IUPAC Name: N-[4-(difluoromethylsulfonyl)phenyl]-1-(4-methylbenzoyl)piperidine-3-carboxamide Traditional Name: N-[4-(difluoromethylsulfonyl)phenyl]-1-p-toluoyl-nipecotamide Formula: C21H22F2N2O4S MolecularWeight: 436.472186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CCCC(C2)C(=O)NC3=CC=C(C=C3)S(=O)(=O)C(F)F

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CCCC(C2)C(=O)NC3=CC=C(C=C3)S(=O)(=O)C(F)F

InChI

InChI=1S/C21H22F2N2O4S/c1-14-4-6-15(7-5-14)20(27)25-12-2-3-16(13-25)19(26)24-17-8-10-18(11-9-17)30(28,29)21(22)23/h4-11,16,21H,2-3,12-13H2,1H3,(H,24,26)