2-methoxy-5-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]oxysulfonyl-benzoic acid

Systemtic Name: 2-methoxy-5-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]oxysulfonyl-benzoic acid Openeye Name: 2-methoxy-5-[5-methyl-2-(p-tolyl)pyrazol-3-yl]oxysulfonyl-benzoic acid CAS Name: 2-methoxy-5-[[5-methyl-2-(4-methylphenyl)-3-pyrazolyl]oxysulfonyl]benzoic acid IUPAC Name: 2-methoxy-5-[5-methyl-2-(4-methylphenyl)pyrazol-3-yl]oxysulfonylbenzoic acid Traditional Name: 2-methoxy-5-[5-methyl-2-(p-tolyl)pyrazol-3-yl]oxysulfonyl-benzoic acid Formula: C19H18N2O6S MolecularWeight: 402.42102

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=CC(=N2)C)OS(=O)(=O)C3=CC(=C(C=C3)OC)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=CC(=N2)C)OS(=O)(=O)C3=CC(=C(C=C3)OC)C(=O)O

InChI

InChI=1S/C19H18N2O6S/c1-12-4-6-14(7-5-12)21-18(10-13(2)20-21)27-28(24,25)15-8-9-17(26-3)16(11-15)19(22)23/h4-11H,1-3H3,(H,22,23)