[5-(3-methoxyphenyl)-1,2-oxazol-3-yl]methyl quinoline-2-carboxylate

Systemtic Name: [5-(3-methoxyphenyl)-1,2-oxazol-3-yl]methyl quinoline-2-carboxylate Openeye Name: [5-(3-methoxyphenyl)isoxazol-3-yl]methyl quinoline-2-carboxylate CAS Name: 2-quinolinecarboxylic acid [5-(3-methoxyphenyl)-3-isoxazolyl]methyl ester IUPAC Name: [5-(3-methoxyphenyl)-1,2-oxazol-3-yl]methyl quinoline-2-carboxylate Traditional Name: quinaldic acid [5-(3-methoxyphenyl)isoxazol-3-yl]methyl ester Formula: C21H16N2O4 MolecularWeight: 360.36274

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=CC(=NO2)COC(=O)C3=NC4=CC=CC=C4C=C3

Isomeric SMILES

COC1=CC=CC(=C1)C2=CC(=NO2)COC(=O)C3=NC4=CC=CC=C4C=C3

InChI

InChI=1S/C21H16N2O4/c1-25-17-7-4-6-15(11-17)20-12-16(23-27-20)13-26-21(24)19-10-9-14-5-2-3-8-18(14)22-19/h2-12H,13H2,1H3