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

Systemtic Name: [3-(2-methylpropyl)-1,2,4-oxadiazol-5-yl]methyl 4-oxidanylidenechromene-2-carboxylate Openeye Name: (3-isobutyl-1,2,4-oxadiazol-5-yl)methyl 4-oxochromene-2-carboxylate CAS Name: 4-oxo-1-benzopyran-2-carboxylic acid [3-(2-methylpropyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: [3-(2-methylpropyl)-1,2,4-oxadiazol-5-yl]methyl 4-oxochromene-2-carboxylate Traditional Name: 4-ketochromene-2-carboxylic acid (3-isobutyl-1,2,4-oxadiazol-5-yl)methyl ester Formula: C17H16N2O5 MolecularWeight: 328.31934

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=NOC(=N1)COC(=O)C2=CC(=O)C3=CC=CC=C3O2

Isomeric SMILES

CC(C)CC1=NOC(=N1)COC(=O)C2=CC(=O)C3=CC=CC=C3O2

InChI

InChI=1S/C17H16N2O5/c1-10(2)7-15-18-16(24-19-15)9-22-17(21)14-8-12(20)11-5-3-4-6-13(11)23-14/h3-6,8,10H,7,9H2,1-2H3