[5-(3,4-dimethoxyphenyl)-1,2-oxazol-3-yl]methyl quinoline-2-carboxylate

Systemtic Name: [5-(3,4-dimethoxyphenyl)-1,2-oxazol-3-yl]methyl quinoline-2-carboxylate Openeye Name: [5-(3,4-dimethoxyphenyl)isoxazol-3-yl]methyl quinoline-2-carboxylate CAS Name: 2-quinolinecarboxylic acid [5-(3,4-dimethoxyphenyl)-3-isoxazolyl]methyl ester IUPAC Name: [5-(3,4-dimethoxyphenyl)-1,2-oxazol-3-yl]methyl quinoline-2-carboxylate Traditional Name: quinaldic acid [5-(3,4-dimethoxyphenyl)isoxazol-3-yl]methyl ester Formula: C22H18N2O5 MolecularWeight: 390.38872

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H18N2O5/c1-26-19-10-8-15(11-21(19)27-2)20-12-16(24-29-20)13-28-22(25)18-9-7-14-5-3-4-6-17(14)23-18/h3-12H,13H2,1-2H3