3-methyl-5-phenyl-2-[(4-pyridin-4-yloxyphenyl)sulfonylamino]benzoic acid

Systemtic Name: 3-methyl-5-phenyl-2-[(4-pyridin-4-yloxyphenyl)sulfonylamino]benzoic acid Openeye Name: 3-methyl-5-phenyl-2-[[4-(4-pyridyloxy)phenyl]sulfonylamino]benzoic acid CAS Name: 3-methyl-5-phenyl-2-[(4-pyridin-4-yloxyphenyl)sulfonylamino]benzoic acid IUPAC Name: 3-methyl-5-phenyl-2-[(4-pyridin-4-yloxyphenyl)sulfonylamino]benzoic acid Traditional Name: 3-methyl-5-phenyl-2-[[4-(4-pyridyloxy)phenyl]sulfonylamino]benzoic acid Formula: C25H20N2O5S MolecularWeight: 460.5017

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1NS(=O)(=O)C2=CC=C(C=C2)OC3=CC=NC=C3)C(=O)O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=CC(=C1NS(=O)(=O)C2=CC=C(C=C2)OC3=CC=NC=C3)C(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C25H20N2O5S/c1-17-15-19(18-5-3-2-4-6-18)16-23(25(28)29)24(17)27-33(30,31)22-9-7-20(8-10-22)32-21-11-13-26-14-12-21/h2-16,27H,1H3,(H,28,29)