(E)-4-(1,3-benzodioxol-5-yl)-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-(1,3-benzodioxol-5-yl)-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-(1,3-benzodioxol-5-yl)-4-oxo-but-2-enoic acid CAS Name: (E)-4-(1,3-benzodioxol-5-yl)-4-oxo-2-butenoic acid IUPAC Name: (E)-4-(1,3-benzodioxol-5-yl)-4-oxobut-2-enoic acid Traditional Name: (E)-4-(1,3-benzodioxol-5-yl)-4-keto-but-2-enoic acid Formula: C11H8O5 MolecularWeight: 220.17822

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)C=CC(=O)O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)/C=C/C(=O)O

InChI

InChI=1S/C11H8O5/c12-8(2-4-11(13)14)7-1-3-9-10(5-7)16-6-15-9/h1-5H,6H2,(H,13,14)/b4-2+