2-[1-[(2-methoxypyridin-3-yl)methyl]piperidin-4-yl]-1-(2-methylsulfonylphenyl)ethanone

Systemtic Name: 2-[1-[(2-methoxypyridin-3-yl)methyl]piperidin-4-yl]-1-(2-methylsulfonylphenyl)ethanone Openeye Name: 2-[1-[(2-methoxy-3-pyridyl)methyl]-4-piperidyl]-1-(2-methylsulfonylphenyl)ethanone CAS Name: 2-[1-[(2-methoxy-3-pyridinyl)methyl]-4-piperidinyl]-1-(2-methylsulfonylphenyl)ethanone IUPAC Name: 2-[1-[(2-methoxypyridin-3-yl)methyl]piperidin-4-yl]-1-(2-methylsulfonylphenyl)ethanone Traditional Name: 1-(2-mesylphenyl)-2-[1-[(2-methoxy-3-pyridyl)methyl]-4-piperidyl]ethanone Formula: C21H26N2O4S MolecularWeight: 402.50714

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC=N1)CN2CCC(CC2)CC(=O)C3=CC=CC=C3S(=O)(=O)C

Isomeric SMILES

COC1=C(C=CC=N1)CN2CCC(CC2)CC(=O)C3=CC=CC=C3S(=O)(=O)C

InChI

InChI=1S/C21H26N2O4S/c1-27-21-17(6-5-11-22-21)15-23-12-9-16(10-13-23)14-19(24)18-7-3-4-8-20(18)28(2,25)26/h3-8,11,16H,9-10,12-15H2,1-2H3