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

Systemtic Name: [3-(4-propan-2-ylphenyl)-1,2,4-oxadiazol-5-yl]methyl 4-oxidanylidenechromene-2-carboxylate Openeye Name: [3-(4-isopropylphenyl)-1,2,4-oxadiazol-5-yl]methyl 4-oxochromene-2-carboxylate CAS Name: 4-oxo-1-benzopyran-2-carboxylic acid [3-(4-propan-2-ylphenyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: [3-(4-propan-2-ylphenyl)-1,2,4-oxadiazol-5-yl]methyl 4-oxochromene-2-carboxylate Traditional Name: 4-ketochromene-2-carboxylic acid (3-p-cumenyl-1,2,4-oxadiazol-5-yl)methyl ester Formula: C22H18N2O5 MolecularWeight: 390.38872

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=NOC(=N2)COC(=O)C3=CC(=O)C4=CC=CC=C4O3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=NOC(=N2)COC(=O)C3=CC(=O)C4=CC=CC=C4O3

InChI

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