(4-methoxycarbonylphenyl) 1-(2,4-dimethylphenyl)sulfonylpiperidine-4-carboxylate

Systemtic Name: (4-methoxycarbonylphenyl) 1-(2,4-dimethylphenyl)sulfonylpiperidine-4-carboxylate Openeye Name: (4-methoxycarbonylphenyl) 1-(2,4-dimethylphenyl)sulfonylpiperidine-4-carboxylate CAS Name: 1-(2,4-dimethylphenyl)sulfonyl-4-piperidinecarboxylic acid (4-methoxycarbonylphenyl) ester IUPAC Name: (4-methoxycarbonylphenyl) 1-(2,4-dimethylphenyl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-(2,4-dimethylphenyl)sulfonylisonipecotic acid (4-carbomethoxyphenyl) ester Formula: C22H25NO6S MolecularWeight: 431.502

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)OC3=CC=C(C=C3)C(=O)OC)C

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)OC3=CC=C(C=C3)C(=O)OC)C

InChI

InChI=1S/C22H25NO6S/c1-15-4-9-20(16(2)14-15)30(26,27)23-12-10-18(11-13-23)22(25)29-19-7-5-17(6-8-19)21(24)28-3/h4-9,14,18H,10-13H2,1-3H3