(E)-3-[6-butyl-4,7-bis(oxidanylidene)-1-benzofuran-2-yl]prop-2-enoic acid

Systemtic Name: (E)-3-[6-butyl-4,7-bis(oxidanylidene)-1-benzofuran-2-yl]prop-2-enoic acid Openeye Name: (E)-3-(6-butyl-4,7-dioxo-benzofuran-2-yl)prop-2-enoic acid CAS Name: (E)-3-(6-butyl-4,7-dioxo-2-benzofuranyl)-2-propenoic acid IUPAC Name: (E)-3-(6-butyl-4,7-dioxo-1-benzofuran-2-yl)prop-2-enoic acid Traditional Name: (E)-3-(6-butyl-4,7-diketo-benzofuran-2-yl)acrylic acid Formula: C15H14O5 MolecularWeight: 274.26866

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=O)C2=C(C1=O)OC(=C2)C=CC(=O)O

Isomeric SMILES

CCCCC1=CC(=O)C2=C(C1=O)OC(=C2)/C=C/C(=O)O

InChI

InChI=1S/C15H14O5/c1-2-3-4-9-7-12(16)11-8-10(5-6-13(17)18)20-15(11)14(9)19/h5-8H,2-4H2,1H3,(H,17,18)/b6-5+