(3,4-dimethylphenyl) 1-(4-propan-2-ylphenyl)sulfonylpiperidine-4-carboxylate

Systemtic Name: (3,4-dimethylphenyl) 1-(4-propan-2-ylphenyl)sulfonylpiperidine-4-carboxylate Openeye Name: (3,4-dimethylphenyl) 1-(4-isopropylphenyl)sulfonylpiperidine-4-carboxylate CAS Name: 1-(4-propan-2-ylphenyl)sulfonyl-4-piperidinecarboxylic acid (3,4-dimethylphenyl) ester IUPAC Name: (3,4-dimethylphenyl) 1-(4-propan-2-ylphenyl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-p-cumenylsulfonylisonipecotic acid (3,4-dimethylphenyl) ester Formula: C23H29NO4S MolecularWeight: 415.54566

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C(C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)OC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C(C)C)C

InChI

InChI=1S/C23H29NO4S/c1-16(2)19-6-9-22(10-7-19)29(26,27)24-13-11-20(12-14-24)23(25)28-21-8-5-17(3)18(4)15-21/h5-10,15-16,20H,11-14H2,1-4H3