[2-[(3-fluorophenyl)amino]-2-oxidanylidene-ethyl] 4-methoxy-3-[(2R)-2-methylpiperidin-1-yl]sulfonyl-benzoate

Systemtic Name: [2-[(3-fluorophenyl)amino]-2-oxidanylidene-ethyl] 4-methoxy-3-[(2R)-2-methylpiperidin-1-yl]sulfonyl-benzoate Openeye Name: [2-(3-fluoroanilino)-2-oxo-ethyl] 4-methoxy-3-[[(2R)-2-methyl-1-piperidyl]sulfonyl]benzoate CAS Name: 4-methoxy-3-[[(2R)-2-methyl-1-piperidinyl]sulfonyl]benzoic acid [2-(3-fluoroanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-fluoroanilino)-2-oxoethyl] 4-methoxy-3-[(2R)-2-methylpiperidin-1-yl]sulfonylbenzoate Traditional Name: 4-methoxy-3-[(2R)-2-methylpiperidino]sulfonyl-benzoic acid [2-(3-fluoroanilino)-2-keto-ethyl] ester Formula: C22H25FN2O6S MolecularWeight: 464.507103

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1S(=O)(=O)C2=C(C=CC(=C2)C(=O)OCC(=O)NC3=CC(=CC=C3)F)OC

Isomeric SMILES

C[C@@H]1CCCCN1S(=O)(=O)C2=C(C=CC(=C2)C(=O)OCC(=O)NC3=CC(=CC=C3)F)OC

InChI

InChI=1S/C22H25FN2O6S/c1-15-6-3-4-11-25(15)32(28,29)20-12-16(9-10-19(20)30-2)22(27)31-14-21(26)24-18-8-5-7-17(23)13-18/h5,7-10,12-13,15H,3-4,6,11,14H2,1-2H3,(H,24,26)/t15-/m1/s1