3-methyl-2-[oxidanyl-(4-pyridin-4-yloxyphenyl)sulfonyl-amino]benzoic acid

Systemtic Name: 3-methyl-2-[oxidanyl-(4-pyridin-4-yloxyphenyl)sulfonyl-amino]benzoic acid Openeye Name: 2-[hydroxy-[4-(4-pyridyloxy)phenyl]sulfonyl-amino]-3-methyl-benzoic acid CAS Name: 2-[hydroxy-(4-pyridin-4-yloxyphenyl)sulfonylamino]-3-methylbenzoic acid IUPAC Name: 2-[hydroxy-(4-pyridin-4-yloxyphenyl)sulfonylamino]-3-methylbenzoic acid Traditional Name: 2-[hydroxy-[4-(4-pyridyloxy)phenyl]sulfonyl-amino]-3-methyl-benzoic acid Formula: C19H16N2O6S MolecularWeight: 400.40514

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1N(O)S(=O)(=O)C2=CC=C(C=C2)OC3=CC=NC=C3)C(=O)O

Isomeric SMILES

CC1=CC=CC(=C1N(O)S(=O)(=O)C2=CC=C(C=C2)OC3=CC=NC=C3)C(=O)O

InChI

InChI=1S/C19H16N2O6S/c1-13-3-2-4-17(19(22)23)18(13)21(24)28(25,26)16-7-5-14(6-8-16)27-15-9-11-20-12-10-15/h2-12,24H,1H3,(H,22,23)