methyl 4-(1,3-benzodioxol-5-yl)-2-oxidanylidene-butanoate

Systemtic Name: methyl 4-(1,3-benzodioxol-5-yl)-2-oxidanylidene-butanoate Openeye Name: methyl 4-(1,3-benzodioxol-5-yl)-2-oxo-butanoate CAS Name: 4-(1,3-benzodioxol-5-yl)-2-oxobutanoic acid methyl ester IUPAC Name: methyl 4-(1,3-benzodioxol-5-yl)-2-oxobutanoate Traditional Name: 4-(1,3-benzodioxol-5-yl)-2-keto-butyric acid methyl ester Formula: C12H12O5 MolecularWeight: 236.22068

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=O)CCC1=CC2=C(C=C1)OCO2

Isomeric SMILES

COC(=O)C(=O)CCC1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C12H12O5/c1-15-12(14)9(13)4-2-8-3-5-10-11(6-8)17-7-16-10/h3,5-6H,2,4,7H2,1H3