5,7-bis(chloranyl)-4-[(4-phenoxyphenyl)methylamino]quinoline-2-carboxylic acid

Systemtic Name: 5,7-bis(chloranyl)-4-[(4-phenoxyphenyl)methylamino]quinoline-2-carboxylic acid Openeye Name: 5,7-dichloro-4-[(4-phenoxyphenyl)methylamino]quinoline-2-carboxylic acid CAS Name: 5,7-dichloro-4-[(4-phenoxyphenyl)methylamino]-2-quinolinecarboxylic acid IUPAC Name: 5,7-dichloro-4-[(4-phenoxyphenyl)methylamino]quinoline-2-carboxylic acid Traditional Name: 5,7-dichloro-4-[(4-phenoxybenzyl)amino]quinaldic acid Formula: C23H16Cl2N2O3 MolecularWeight: 439.29074

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)CNC3=CC(=NC4=CC(=CC(=C43)Cl)Cl)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)CNC3=CC(=NC4=CC(=CC(=C43)Cl)Cl)C(=O)O

InChI

InChI=1S/C23H16Cl2N2O3/c24-15-10-18(25)22-19(12-21(23(28)29)27-20(22)11-15)26-13-14-6-8-17(9-7-14)30-16-4-2-1-3-5-16/h1-12H,13H2,(H,26,27)(H,28,29)