(E)-6-(3-oxidanylidene-1H-2-benzofuran-5-yl)hex-4-enoic acid

Systemtic Name: (E)-6-(3-oxidanylidene-1H-2-benzofuran-5-yl)hex-4-enoic acid Openeye Name: (E)-6-(3-oxo-1H-isobenzofuran-5-yl)hex-4-enoic acid CAS Name: (E)-6-(3-oxo-1H-isobenzofuran-5-yl)-4-hexenoic acid IUPAC Name: (E)-6-(3-oxo-1H-2-benzofuran-5-yl)hex-4-enoic acid Traditional Name: (E)-6-(3-ketophthalan-5-yl)hex-4-enoic acid Formula: C14H14O4 MolecularWeight: 246.25856

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=C(C=C2)CC=CCCC(=O)O)C(=O)O1

Isomeric SMILES

C1C2=C(C=C(C=C2)C/C=C/CCC(=O)O)C(=O)O1

InChI

InChI=1S/C14H14O4/c15-13(16)5-3-1-2-4-10-6-7-11-9-18-14(17)12(11)8-10/h1-2,6-8H,3-5,9H2,(H,15,16)/b2-1+