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

Systemtic Name: methyl 4-[4-[3-methyl-4-(6-propoxypyridin-2-yl)phenyl]piperidin-1-yl]sulfonyl-1-(phenylmethyl)piperidine-4-carboxylate Openeye Name: methyl 1-benzyl-4-[[4-[3-methyl-4-(6-propoxy-2-pyridyl)phenyl]-1-piperidyl]sulfonyl]piperidine-4-carboxylate CAS Name: 4-[[4-[3-methyl-4-(6-propoxy-2-pyridinyl)phenyl]-1-piperidinyl]sulfonyl]-1-(phenylmethyl)-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-benzyl-4-[4-[3-methyl-4-(6-propoxypyridin-2-yl)phenyl]piperidin-1-yl]sulfonylpiperidine-4-carboxylate Traditional Name: 1-benzyl-4-[4-[3-methyl-4-(6-propoxy-2-pyridyl)phenyl]piperidino]sulfonyl-isonipecotic acid methyl ester Formula: C34H43N3O5S MolecularWeight: 605.78732

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC(=N1)C2=C(C=C(C=C2)C3CCN(CC3)S(=O)(=O)C4(CCN(CC4)CC5=CC=CC=C5)C(=O)OC)C

Isomeric SMILES

CCCOC1=CC=CC(=N1)C2=C(C=C(C=C2)C3CCN(CC3)S(=O)(=O)C4(CCN(CC4)CC5=CC=CC=C5)C(=O)OC)C

InChI

InChI=1S/C34H43N3O5S/c1-4-23-42-32-12-8-11-31(35-32)30-14-13-29(24-26(30)2)28-15-19-37(20-16-28)43(39,40)34(33(38)41-3)17-21-36(22-18-34)25-27-9-6-5-7-10-27/h5-14,24,28H,4,15-23,25H2,1-3H3