methyl 4-[4-[1-(2-methoxyphenyl)piperidin-4-yl]piperidin-1-yl]sulfonyl-1-(phenylmethyl)piperidine-4-carboxylate

Systemtic Name: methyl 4-[4-[1-(2-methoxyphenyl)piperidin-4-yl]piperidin-1-yl]sulfonyl-1-(phenylmethyl)piperidine-4-carboxylate Openeye Name: methyl 1-benzyl-4-[[4-[1-(2-methoxyphenyl)-4-piperidyl]-1-piperidyl]sulfonyl]piperidine-4-carboxylate CAS Name: 4-[[4-[1-(2-methoxyphenyl)-4-piperidinyl]-1-piperidinyl]sulfonyl]-1-(phenylmethyl)-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-benzyl-4-[4-[1-(2-methoxyphenyl)piperidin-4-yl]piperidin-1-yl]sulfonylpiperidine-4-carboxylate Traditional Name: 1-benzyl-4-[4-[1-(2-methoxyphenyl)-4-piperidyl]piperidino]sulfonyl-isonipecotic acid methyl ester Formula: C31H43N3O5S MolecularWeight: 569.75522

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCC(CC2)C3CCN(CC3)S(=O)(=O)C4(CCN(CC4)CC5=CC=CC=C5)C(=O)OC

Isomeric SMILES

COC1=CC=CC=C1N2CCC(CC2)C3CCN(CC3)S(=O)(=O)C4(CCN(CC4)CC5=CC=CC=C5)C(=O)OC

InChI

InChI=1S/C31H43N3O5S/c1-38-29-11-7-6-10-28(29)33-18-12-26(13-19-33)27-14-20-34(21-15-27)40(36,37)31(30(35)39-2)16-22-32(23-17-31)24-25-8-4-3-5-9-25/h3-11,26-27H,12-24H2,1-2H3