2-[3-(4-chlorophenyl)-2,1-benzoxazol-5-yl]-8-methyl-quinoline-4-carboxylic acid

Systemtic Name: 2-[3-(4-chlorophenyl)-2,1-benzoxazol-5-yl]-8-methyl-quinoline-4-carboxylic acid Openeye Name: 2-[3-(4-chlorophenyl)-2,1-benzoxazol-5-yl]-8-methyl-quinoline-4-carboxylic acid CAS Name: 2-[3-(4-chlorophenyl)-2,1-benzoxazol-5-yl]-8-methyl-4-quinolinecarboxylic acid IUPAC Name: 2-[3-(4-chlorophenyl)-2,1-benzoxazol-5-yl]-8-methylquinoline-4-carboxylic acid Traditional Name: 2-[3-(4-chlorophenyl)anthranil-5-yl]-8-methyl-cinchoninic acid Formula: C24H15ClN2O3 MolecularWeight: 414.8405

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C(C=C2C(=O)O)C3=CC4=C(ON=C4C=C3)C5=CC=C(C=C5)Cl

Isomeric SMILES

CC1=CC=CC2=C1N=C(C=C2C(=O)O)C3=CC4=C(ON=C4C=C3)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C24H15ClN2O3/c1-13-3-2-4-17-18(24(28)29)12-21(26-22(13)17)15-7-10-20-19(11-15)23(30-27-20)14-5-8-16(25)9-6-14/h2-12H,1H3,(H,28,29)