[3-(2-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl 2-oxidanylidene-1H-quinoline-4-carboxylate

Systemtic Name: [3-(2-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl 2-oxidanylidene-1H-quinoline-4-carboxylate Openeye Name: [3-(o-tolyl)-1,2,4-oxadiazol-5-yl]methyl 2-oxo-1H-quinoline-4-carboxylate CAS Name: 2-oxo-1H-quinoline-4-carboxylic acid [3-(2-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: [3-(2-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl 2-oxo-1H-quinoline-4-carboxylate Traditional Name: 2-keto-1H-quinoline-4-carboxylic acid [3-(o-tolyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C20H15N3O4 MolecularWeight: 361.3508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NOC(=N2)COC(=O)C3=CC(=O)NC4=CC=CC=C43

Isomeric SMILES

CC1=CC=CC=C1C2=NOC(=N2)COC(=O)C3=CC(=O)NC4=CC=CC=C43

InChI

InChI=1S/C20H15N3O4/c1-12-6-2-3-7-13(12)19-22-18(27-23-19)11-26-20(25)15-10-17(24)21-16-9-5-4-8-14(15)16/h2-10H,11H2,1H3,(H,21,24)