2-methylpropyl 4-[[2-(1,3-benzodioxol-5-yl)-5-oxidanylidene-1,3-oxazol-4-ylidene]methyl]benzoate

Systemtic Name: 2-methylpropyl 4-[[2-(1,3-benzodioxol-5-yl)-5-oxidanylidene-1,3-oxazol-4-ylidene]methyl]benzoate Openeye Name: isobutyl 4-[[2-(1,3-benzodioxol-5-yl)-5-oxo-oxazol-4-ylidene]methyl]benzoate CAS Name: 4-[[2-(1,3-benzodioxol-5-yl)-5-oxo-4-oxazolylidene]methyl]benzoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 4-[[2-(1,3-benzodioxol-5-yl)-5-oxo-1,3-oxazol-4-ylidene]methyl]benzoate Traditional Name: 4-[[2-(1,3-benzodioxol-5-yl)-5-keto-2-oxazolin-4-ylidene]methyl]benzoic acid isobutyl ester Formula: C22H19NO6 MolecularWeight: 393.38936

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)C1=CC=C(C=C1)C=C2C(=O)OC(=N2)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC(C)COC(=O)C1=CC=C(C=C1)C=C2C(=O)OC(=N2)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C22H19NO6/c1-13(2)11-26-21(24)15-5-3-14(4-6-15)9-17-22(25)29-20(23-17)16-7-8-18-19(10-16)28-12-27-18/h3-10,13H,11-12H2,1-2H3