2-[4-[(4-azanyl-2-methoxy-5-methyl-phenyl)diazenyl]phenyl]quinoline-4-carboxylic acid

Systemtic Name: 2-[4-[(4-azanyl-2-methoxy-5-methyl-phenyl)diazenyl]phenyl]quinoline-4-carboxylic acid Openeye Name: 2-[4-(4-amino-2-methoxy-5-methyl-phenyl)azophenyl]quinoline-4-carboxylic acid CAS Name: 2-[4-(4-amino-2-methoxy-5-methylphenyl)azophenyl]-4-quinolinecarboxylic acid IUPAC Name: 2-[4-[(4-amino-2-methoxy-5-methylphenyl)diazenyl]phenyl]quinoline-4-carboxylic acid Traditional Name: 2-[4-(4-amino-2-methoxy-5-methyl-phenyl)azophenyl]cinchoninic acid Formula: C24H20N4O3 MolecularWeight: 412.4406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1N)OC)N=NC2=CC=C(C=C2)C3=NC4=CC=CC=C4C(=C3)C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1N)OC)N=NC2=CC=C(C=C2)C3=NC4=CC=CC=C4C(=C3)C(=O)O

InChI

InChI=1S/C24H20N4O3/c1-14-11-22(23(31-2)13-19(14)25)28-27-16-9-7-15(8-10-16)21-12-18(24(29)30)17-5-3-4-6-20(17)26-21/h3-13H,25H2,1-2H3,(H,29,30)