(4-methoxyphenyl)methyl 1-(2,4-dimethylphenyl)sulfonylpiperidine-4-carboxylate

Systemtic Name: (4-methoxyphenyl)methyl 1-(2,4-dimethylphenyl)sulfonylpiperidine-4-carboxylate Openeye Name: (4-methoxyphenyl)methyl 1-(2,4-dimethylphenyl)sulfonylpiperidine-4-carboxylate CAS Name: 1-(2,4-dimethylphenyl)sulfonyl-4-piperidinecarboxylic acid (4-methoxyphenyl)methyl ester IUPAC Name: (4-methoxyphenyl)methyl 1-(2,4-dimethylphenyl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-(2,4-dimethylphenyl)sulfonylisonipecotic acid p-anisyl ester Formula: C22H27NO5S MolecularWeight: 417.51848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)OCC3=CC=C(C=C3)OC)C

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)OCC3=CC=C(C=C3)OC)C

InChI

InChI=1S/C22H27NO5S/c1-16-4-9-21(17(2)14-16)29(25,26)23-12-10-19(11-13-23)22(24)28-15-18-5-7-20(27-3)8-6-18/h4-9,14,19H,10-13,15H2,1-3H3