[2-(3,4-dimethoxyphenyl)-2-oxidanylidene-ethyl] 4-methyl-3-(4-methylpiperidin-1-yl)sulfonyl-benzoate

Systemtic Name: [2-(3,4-dimethoxyphenyl)-2-oxidanylidene-ethyl] 4-methyl-3-(4-methylpiperidin-1-yl)sulfonyl-benzoate Openeye Name: [2-(3,4-dimethoxyphenyl)-2-oxo-ethyl] 4-methyl-3-[(4-methyl-1-piperidyl)sulfonyl]benzoate CAS Name: 4-methyl-3-[(4-methyl-1-piperidinyl)sulfonyl]benzoic acid [2-(3,4-dimethoxyphenyl)-2-oxoethyl] ester IUPAC Name: [2-(3,4-dimethoxyphenyl)-2-oxoethyl] 4-methyl-3-(4-methylpiperidin-1-yl)sulfonylbenzoate Traditional Name: 4-methyl-3-(4-methylpiperidino)sulfonyl-benzoic acid [2-(3,4-dimethoxyphenyl)-2-keto-ethyl] ester Formula: C24H29NO7S MolecularWeight: 475.55456

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)OCC(=O)C3=CC(=C(C=C3)OC)OC)C

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)OCC(=O)C3=CC(=C(C=C3)OC)OC)C

InChI

InChI=1S/C24H29NO7S/c1-16-9-11-25(12-10-16)33(28,29)23-14-19(6-5-17(23)2)24(27)32-15-20(26)18-7-8-21(30-3)22(13-18)31-4/h5-8,13-14,16H,9-12,15H2,1-4H3