2-methoxy-5-[[[1-(4-propan-2-ylphenyl)sulfonylpiperidin-4-yl]carbonylamino]methyl]benzoic acid

Systemtic Name: 2-methoxy-5-[[[1-(4-propan-2-ylphenyl)sulfonylpiperidin-4-yl]carbonylamino]methyl]benzoic acid Openeye Name: 5-[[[1-(4-isopropylphenyl)sulfonylpiperidine-4-carbonyl]amino]methyl]-2-methoxy-benzoic acid CAS Name: 2-methoxy-5-[[[oxo-[1-(4-propan-2-ylphenyl)sulfonyl-4-piperidinyl]methyl]amino]methyl]benzoic acid IUPAC Name: 2-methoxy-5-[[[1-(4-propan-2-ylphenyl)sulfonylpiperidine-4-carbonyl]amino]methyl]benzoic acid Traditional Name: 2-methoxy-5-[[(1-p-cumenylsulfonylisonipecotoyl)amino]methyl]benzoic acid Formula: C24H30N2O6S MolecularWeight: 474.5698

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H30N2O6S/c1-16(2)18-5-7-20(8-6-18)33(30,31)26-12-10-19(11-13-26)23(27)25-15-17-4-9-22(32-3)21(14-17)24(28)29/h4-9,14,16,19H,10-13,15H2,1-3H3,(H,25,27)(H,28,29)