2-[4-[(4-methylphenyl)sulfonylamino]phenyl]quinoline-4-carboxylic acid

Systemtic Name: 2-[4-[(4-methylphenyl)sulfonylamino]phenyl]quinoline-4-carboxylic acid Openeye Name: 2-[4-(p-tolylsulfonylamino)phenyl]quinoline-4-carboxylic acid CAS Name: 2-[4-[(4-methylphenyl)sulfonylamino]phenyl]-4-quinolinecarboxylic acid IUPAC Name: 2-[4-[(4-methylphenyl)sulfonylamino]phenyl]quinoline-4-carboxylic acid Traditional Name: 2-[4-(tosylamino)phenyl]cinchoninic acid Formula: C23H18N2O4S MolecularWeight: 418.46502

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C3=NC4=CC=CC=C4C(=C3)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C3=NC4=CC=CC=C4C(=C3)C(=O)O

InChI

InChI=1S/C23H18N2O4S/c1-15-6-12-18(13-7-15)30(28,29)25-17-10-8-16(9-11-17)22-14-20(23(26)27)19-4-2-3-5-21(19)24-22/h2-14,25H,1H3,(H,26,27)