methyl 1-[4-[(6-methylpyridin-2-yl)carbonylamino]phenyl]sulfonylpiperidine-3-carboxylate

Systemtic Name: methyl 1-[4-[(6-methylpyridin-2-yl)carbonylamino]phenyl]sulfonylpiperidine-3-carboxylate Openeye Name: methyl 1-[4-[(6-methylpyridine-2-carbonyl)amino]phenyl]sulfonylpiperidine-3-carboxylate CAS Name: 1-[4-[[(6-methyl-2-pyridinyl)-oxomethyl]amino]phenyl]sulfonyl-3-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[4-[(6-methylpyridine-2-carbonyl)amino]phenyl]sulfonylpiperidine-3-carboxylate Traditional Name: 1-[4-[(6-methylpicolinoyl)amino]phenyl]sulfonylnipecotic acid methyl ester Formula: C20H23N3O5S MolecularWeight: 417.47872

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=N1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCC(C3)C(=O)OC

Isomeric SMILES

CC1=CC=CC(=N1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCC(C3)C(=O)OC

InChI

InChI=1S/C20H23N3O5S/c1-14-5-3-7-18(21-14)19(24)22-16-8-10-17(11-9-16)29(26,27)23-12-4-6-15(13-23)20(25)28-2/h3,5,7-11,15H,4,6,12-13H2,1-2H3,(H,22,24)