methyl 1-[3-[(2,4-dimethylphenyl)sulfamoyl]-4-methyl-phenyl]carbonylpiperidine-4-carboxylate

Systemtic Name: methyl 1-[3-[(2,4-dimethylphenyl)sulfamoyl]-4-methyl-phenyl]carbonylpiperidine-4-carboxylate Openeye Name: methyl 1-[3-[(2,4-dimethylphenyl)sulfamoyl]-4-methyl-benzoyl]piperidine-4-carboxylate CAS Name: 1-[[3-[(2,4-dimethylphenyl)sulfamoyl]-4-methylphenyl]-oxomethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[3-[(2,4-dimethylphenyl)sulfamoyl]-4-methylbenzoyl]piperidine-4-carboxylate Traditional Name: 1-[3-[(2,4-dimethylphenyl)sulfamoyl]-4-methyl-benzoyl]isonipecotic acid methyl ester Formula: C23H28N2O5S MolecularWeight: 444.54382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NS(=O)(=O)C2=C(C=CC(=C2)C(=O)N3CCC(CC3)C(=O)OC)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)NS(=O)(=O)C2=C(C=CC(=C2)C(=O)N3CCC(CC3)C(=O)OC)C)C

InChI

InChI=1S/C23H28N2O5S/c1-15-5-8-20(17(3)13-15)24-31(28,29)21-14-19(7-6-16(21)2)22(26)25-11-9-18(10-12-25)23(27)30-4/h5-8,13-14,18,24H,9-12H2,1-4H3