1-(3,4-dimethoxyphenyl)sulfonyl-N-(2-fluoranyl-4-methyl-phenyl)piperidine-4-carboxamide

Systemtic Name: 1-(3,4-dimethoxyphenyl)sulfonyl-N-(2-fluoranyl-4-methyl-phenyl)piperidine-4-carboxamide Openeye Name: 1-(3,4-dimethoxyphenyl)sulfonyl-N-(2-fluoro-4-methyl-phenyl)piperidine-4-carboxamide CAS Name: 1-(3,4-dimethoxyphenyl)sulfonyl-N-(2-fluoro-4-methylphenyl)-4-piperidinecarboxamide IUPAC Name: 1-(3,4-dimethoxyphenyl)sulfonyl-N-(2-fluoro-4-methylphenyl)piperidine-4-carboxamide Traditional Name: 1-(3,4-dimethoxyphenyl)sulfonyl-N-(2-fluoro-4-methyl-phenyl)isonipecotamide Formula: C21H25FN2O5S MolecularWeight: 436.497003

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)OC)OC)F

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)OC)OC)F

InChI

InChI=1S/C21H25FN2O5S/c1-14-4-6-18(17(22)12-14)23-21(25)15-8-10-24(11-9-15)30(26,27)16-5-7-19(28-2)20(13-16)29-3/h4-7,12-13,15H,8-11H2,1-3H3,(H,23,25)