ethyl (E)-4-(1,3-benzodioxol-5-yl)-2-oxidanylidene-but-3-enoate

Systemtic Name: ethyl (E)-4-(1,3-benzodioxol-5-yl)-2-oxidanylidene-but-3-enoate Openeye Name: ethyl (E)-4-(1,3-benzodioxol-5-yl)-2-oxo-but-3-enoate CAS Name: (E)-4-(1,3-benzodioxol-5-yl)-2-oxo-3-butenoic acid ethyl ester IUPAC Name: ethyl (E)-4-(1,3-benzodioxol-5-yl)-2-oxobut-3-enoate Traditional Name: (E)-4-(1,3-benzodioxol-5-yl)-2-keto-but-3-enoic acid ethyl ester Formula: C13H12O5 MolecularWeight: 248.23138

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=O)C=CC1=CC2=C(C=C1)OCO2

Isomeric SMILES

CCOC(=O)C(=O)/C=C/C1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C13H12O5/c1-2-16-13(15)10(14)5-3-9-4-6-11-12(7-9)18-8-17-11/h3-7H,2,8H2,1H3/b5-3+