2-[3-(4-methylphenyl)-2,1-benzoxazol-5-yl]quinoline-4-carboxylate

Systemtic Name: 2-[3-(4-methylphenyl)-2,1-benzoxazol-5-yl]quinoline-4-carboxylate Openeye Name: 2-[3-(p-tolyl)-2,1-benzoxazol-5-yl]quinoline-4-carboxylate CAS Name: 2-[3-(4-methylphenyl)-2,1-benzoxazol-5-yl]-4-quinolinecarboxylate IUPAC Name: 2-[3-(4-methylphenyl)-2,1-benzoxazol-5-yl]quinoline-4-carboxylate Traditional Name: 2-[3-(p-tolyl)anthranil-5-yl]cinchoninate Formula: C24H15N2O3- MolecularWeight: 379.3875

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C3C=C(C=CC3=NO2)C4=NC5=CC=CC=C5C(=C4)C(=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=C3C=C(C=CC3=NO2)C4=NC5=CC=CC=C5C(=C4)C(=O)[O-]

InChI

InChI=1S/C24H16N2O3/c1-14-6-8-15(9-7-14)23-19-12-16(10-11-21(19)26-29-23)22-13-18(24(27)28)17-4-2-3-5-20(17)25-22/h2-13H,1H3,(H,27,28)/p-1