2-methoxy-5-[[[1-(2,4,6-trimethylphenyl)sulfonylpiperidin-4-yl]carbonylamino]methyl]benzoic acid

Systemtic Name: 2-methoxy-5-[[[1-(2,4,6-trimethylphenyl)sulfonylpiperidin-4-yl]carbonylamino]methyl]benzoic acid Openeye Name: 2-methoxy-5-[[[1-(2,4,6-trimethylphenyl)sulfonylpiperidine-4-carbonyl]amino]methyl]benzoic acid CAS Name: 2-methoxy-5-[[[oxo-[1-(2,4,6-trimethylphenyl)sulfonyl-4-piperidinyl]methyl]amino]methyl]benzoic acid IUPAC Name: 2-methoxy-5-[[[1-(2,4,6-trimethylphenyl)sulfonylpiperidine-4-carbonyl]amino]methyl]benzoic acid Traditional Name: 5-[[(1-mesitylsulfonylisonipecotoyl)amino]methyl]-2-methoxy-benzoic acid Formula: C24H30N2O6S MolecularWeight: 474.5698

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCC(CC2)C(=O)NCC3=CC(=C(C=C3)OC)C(=O)O)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCC(CC2)C(=O)NCC3=CC(=C(C=C3)OC)C(=O)O)C

InChI

InChI=1S/C24H30N2O6S/c1-15-11-16(2)22(17(3)12-15)33(30,31)26-9-7-19(8-10-26)23(27)25-14-18-5-6-21(32-4)20(13-18)24(28)29/h5-6,11-13,19H,7-10,14H2,1-4H3,(H,25,27)(H,28,29)