7-methyl-5-[(Z)-3-methyl-6-oxidanyl-6-oxidanylidene-hex-2-enyl]-3-oxidanylidene-6-pent-2-ynyl-1H-2-benzofuran-4-carboxylic acid

Systemtic Name: 7-methyl-5-[(Z)-3-methyl-6-oxidanyl-6-oxidanylidene-hex-2-enyl]-3-oxidanylidene-6-pent-2-ynyl-1H-2-benzofuran-4-carboxylic acid Openeye Name: 5-[(Z)-6-hydroxy-3-methyl-6-oxo-hex-2-enyl]-7-methyl-3-oxo-6-pent-2-ynyl-1H-isobenzofuran-4-carboxylic acid CAS Name: 5-[(Z)-6-hydroxy-3-methyl-6-oxohex-2-enyl]-7-methyl-3-oxo-6-pent-2-ynyl-1H-isobenzofuran-4-carboxylic acid IUPAC Name: 5-[(Z)-6-hydroxy-3-methyl-6-oxohex-2-enyl]-7-methyl-3-oxo-6-pent-2-ynyl-1H-2-benzofuran-4-carboxylic acid Traditional Name: 5-[(Z)-6-hydroxy-6-keto-3-methyl-hex-2-enyl]-3-keto-7-methyl-6-pent-2-ynyl-phthalan-4-carboxylic acid Formula: C22H24O6 MolecularWeight: 384.42236

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Descriptors Computed from Structure

Canonical SMILES:

CCC#CCC1=C(C(=C2C(=C1C)COC2=O)C(=O)O)CC=C(C)CCC(=O)O

Isomeric SMILES

CCC#CCC1=C(C(=C2C(=C1C)COC2=O)C(=O)O)C/C=C(/C)\CCC(=O)O

InChI

InChI=1S/C22H24O6/c1-4-5-6-7-15-14(3)17-12-28-22(27)20(17)19(21(25)26)16(15)10-8-13(2)9-11-18(23)24/h8H,4,7,9-12H2,1-3H3,(H,23,24)(H,25,26)/b13-8-