methyl 3-[4-[2-(3,5-dimethoxyphenyl)ethyl]piperidin-1-yl]sulfonylbenzoate

Systemtic Name: methyl 3-[4-[2-(3,5-dimethoxyphenyl)ethyl]piperidin-1-yl]sulfonylbenzoate Openeye Name: methyl 3-[[4-[2-(3,5-dimethoxyphenyl)ethyl]-1-piperidyl]sulfonyl]benzoate CAS Name: 3-[[4-[2-(3,5-dimethoxyphenyl)ethyl]-1-piperidinyl]sulfonyl]benzoic acid methyl ester IUPAC Name: methyl 3-[4-[2-(3,5-dimethoxyphenyl)ethyl]piperidin-1-yl]sulfonylbenzoate Traditional Name: 3-[4-[2-(3,5-dimethoxyphenyl)ethyl]piperidino]sulfonylbenzoic acid methyl ester Formula: C23H29NO6S MolecularWeight: 447.54446

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)CCC2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)C(=O)OC)OC

Isomeric SMILES

COC1=CC(=CC(=C1)CCC2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)C(=O)OC)OC

InChI

InChI=1S/C23H29NO6S/c1-28-20-13-18(14-21(16-20)29-2)8-7-17-9-11-24(12-10-17)31(26,27)22-6-4-5-19(15-22)23(25)30-3/h4-6,13-17H,7-12H2,1-3H3