methyl 1-[4-[(2-fluorophenyl)carbonylamino]phenyl]sulfonylpiperidine-3-carboxylate

Systemtic Name: methyl 1-[4-[(2-fluorophenyl)carbonylamino]phenyl]sulfonylpiperidine-3-carboxylate Openeye Name: methyl 1-[4-[(2-fluorobenzoyl)amino]phenyl]sulfonylpiperidine-3-carboxylate CAS Name: 1-[4-[[(2-fluorophenyl)-oxomethyl]amino]phenyl]sulfonyl-3-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[4-[(2-fluorobenzoyl)amino]phenyl]sulfonylpiperidine-3-carboxylate Traditional Name: 1-[4-[(2-fluorobenzoyl)amino]phenyl]sulfonylnipecotic acid methyl ester Formula: C20H21FN2O5S MolecularWeight: 420.454543

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3F

Isomeric SMILES

COC(=O)C1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3F

InChI

InChI=1S/C20H21FN2O5S/c1-28-20(25)14-5-4-12-23(13-14)29(26,27)16-10-8-15(9-11-16)22-19(24)17-6-2-3-7-18(17)21/h2-3,6-11,14H,4-5,12-13H2,1H3,(H,22,24)