methyl 4-[4-[4-[6-(2-hydroxyethyloxy)pyridin-2-yl]-3-methyl-phenyl]piperidin-1-yl]sulfonyl-1-methyl-piperidine-4-carboxylate

Systemtic Name: methyl 4-[4-[4-[6-(2-hydroxyethyloxy)pyridin-2-yl]-3-methyl-phenyl]piperidin-1-yl]sulfonyl-1-methyl-piperidine-4-carboxylate Openeye Name: methyl 4-[[4-[4-[6-(2-hydroxyethoxy)-2-pyridyl]-3-methyl-phenyl]-1-piperidyl]sulfonyl]-1-methyl-piperidine-4-carboxylate CAS Name: 4-[[4-[4-[6-(2-hydroxyethoxy)-2-pyridinyl]-3-methylphenyl]-1-piperidinyl]sulfonyl]-1-methyl-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 4-[4-[4-[6-(2-hydroxyethoxy)pyridin-2-yl]-3-methylphenyl]piperidin-1-yl]sulfonyl-1-methylpiperidine-4-carboxylate Traditional Name: 4-[4-[4-[6-(2-hydroxyethoxy)-2-pyridyl]-3-methyl-phenyl]piperidino]sulfonyl-1-methyl-isonipecotic acid methyl ester Formula: C27H37N3O6S MolecularWeight: 531.66418

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2CCN(CC2)S(=O)(=O)C3(CCN(CC3)C)C(=O)OC)C4=NC(=CC=C4)OCCO

Isomeric SMILES

CC1=C(C=CC(=C1)C2CCN(CC2)S(=O)(=O)C3(CCN(CC3)C)C(=O)OC)C4=NC(=CC=C4)OCCO

InChI

InChI=1S/C27H37N3O6S/c1-20-19-22(7-8-23(20)24-5-4-6-25(28-24)36-18-17-31)21-9-13-30(14-10-21)37(33,34)27(26(32)35-3)11-15-29(2)16-12-27/h4-8,19,21,31H,9-18H2,1-3H3