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

Systemtic Name: [5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]methyl 4-oxidanylidenechromene-2-carboxylate Openeye Name: [5-(m-tolyl)-1,3,4-oxadiazol-2-yl]methyl 4-oxochromene-2-carboxylate CAS Name: 4-oxo-1-benzopyran-2-carboxylic acid [5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]methyl ester IUPAC Name: [5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]methyl 4-oxochromene-2-carboxylate Traditional Name: 4-ketochromene-2-carboxylic acid [5-(m-tolyl)-1,3,4-oxadiazol-2-yl]methyl ester Formula: C20H14N2O5 MolecularWeight: 362.33556

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NN=C(O2)COC(=O)C3=CC(=O)C4=CC=CC=C4O3

Isomeric SMILES

CC1=CC=CC(=C1)C2=NN=C(O2)COC(=O)C3=CC(=O)C4=CC=CC=C4O3

InChI

InChI=1S/C20H14N2O5/c1-12-5-4-6-13(9-12)19-22-21-18(27-19)11-25-20(24)17-10-15(23)14-7-2-3-8-16(14)26-17/h2-10H,11H2,1H3