O4-[2-(1,3-benzodioxol-5-yl)-2-oxidanylidene-ethyl] O1-ethyl (E)-but-2-enedioate

Systemtic Name: O4-[2-(1,3-benzodioxol-5-yl)-2-oxidanylidene-ethyl] O1-ethyl (E)-but-2-enedioate Openeye Name: O4-[2-(1,3-benzodioxol-5-yl)-2-oxo-ethyl] O1-ethyl (E)-but-2-enedioate CAS Name: (E)-2-butenedioic acid O4-[2-(1,3-benzodioxol-5-yl)-2-oxoethyl] ester O1-ethyl ester IUPAC Name: 4-O-[2-(1,3-benzodioxol-5-yl)-2-oxoethyl] 1-O-ethyl (E)-but-2-enedioate Traditional Name: (E)-but-2-enedioic acid O4-[2-(1,3-benzodioxol-5-yl)-2-keto-ethyl] ester O1-ethyl ester Formula: C15H14O7 MolecularWeight: 306.26746

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC(=O)OCC(=O)C1=CC2=C(C=C1)OCO2

Isomeric SMILES

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

InChI

InChI=1S/C15H14O7/c1-2-19-14(17)5-6-15(18)20-8-11(16)10-3-4-12-13(7-10)22-9-21-12/h3-7H,2,8-9H2,1H3/b6-5+