N-[4-[bis(fluoranyl)methoxy]-3-(4-methoxyphenyl)phenyl]-1-methylsulfonyl-piperidine-2-carboxamide

Systemtic Name: N-[4-[bis(fluoranyl)methoxy]-3-(4-methoxyphenyl)phenyl]-1-methylsulfonyl-piperidine-2-carboxamide Openeye Name: N-[4-(difluoromethoxy)-3-(4-methoxyphenyl)phenyl]-1-methylsulfonyl-piperidine-2-carboxamide CAS Name: N-[4-(difluoromethoxy)-3-(4-methoxyphenyl)phenyl]-1-methylsulfonyl-2-piperidinecarboxamide IUPAC Name: N-[4-(difluoromethoxy)-3-(4-methoxyphenyl)phenyl]-1-methylsulfonylpiperidine-2-carboxamide Traditional Name: N-[4-(difluoromethoxy)-3-(4-methoxyphenyl)phenyl]-1-mesyl-pipecolinamide Formula: C21H24F2N2O5S MolecularWeight: 454.487466

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(C=CC(=C2)NC(=O)C3CCCCN3S(=O)(=O)C)OC(F)F

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(C=CC(=C2)NC(=O)C3CCCCN3S(=O)(=O)C)OC(F)F

InChI

InChI=1S/C21H24F2N2O5S/c1-29-16-9-6-14(7-10-16)17-13-15(8-11-19(17)30-21(22)23)24-20(26)18-5-3-4-12-25(18)31(2,27)28/h6-11,13,18,21H,3-5,12H2,1-2H3,(H,24,26)