N-[4-[(3R,5R)-3,5-dimethylpiperidin-1-yl]sulfonylphenyl]-2-fluoranyl-4-methoxy-benzamide

Systemtic Name: N-[4-[(3R,5R)-3,5-dimethylpiperidin-1-yl]sulfonylphenyl]-2-fluoranyl-4-methoxy-benzamide Openeye Name: N-[4-[[(3R,5R)-3,5-dimethyl-1-piperidyl]sulfonyl]phenyl]-2-fluoro-4-methoxy-benzamide CAS Name: N-[4-[[(3R,5R)-3,5-dimethyl-1-piperidinyl]sulfonyl]phenyl]-2-fluoro-4-methoxybenzamide IUPAC Name: N-[4-[(3R,5R)-3,5-dimethylpiperidin-1-yl]sulfonylphenyl]-2-fluoro-4-methoxybenzamide Traditional Name: N-[4-[(3R,5R)-3,5-dimethylpiperidino]sulfonylphenyl]-2-fluoro-4-methoxy-benzamide Formula: C21H25FN2O4S MolecularWeight: 420.497603

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=C(C=C(C=C3)OC)F)C

Isomeric SMILES

C[C@@H]1C[C@H](CN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=C(C=C(C=C3)OC)F)C

InChI

InChI=1S/C21H25FN2O4S/c1-14-10-15(2)13-24(12-14)29(26,27)18-7-4-16(5-8-18)23-21(25)19-9-6-17(28-3)11-20(19)22/h4-9,11,14-15H,10,12-13H2,1-3H3,(H,23,25)/t14-,15-/m1/s1