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

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

Systemtic Name:propyl 4-[[2-(1,3-benzodioxol-5-yl)-5-oxidanylidene-1,3-oxazol-4-ylidene]methyl]benzoate
Openeye Name:propyl 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 propyl ester
IUPAC Name:propyl 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 propyl ester
Formula: C21H17NO6
MolecularWeight: 379.36278
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C21H17NO6/c1-2-9-25-20(23)14-5-3-13(4-6-14)10-16-21(24)28-19(22-16)15-7-8-17-18(11-15)27-12-26-17/h3-8,10-11H,2,9,12H2,1H3


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