[(E)-1-(6-methoxy-7-methyl-4-oxidanyl-3-oxidanylidene-1H-2-benzofuran-5-yl)-6-methyl-1-phosphono-oct-6-enyl]phosphonic acid

Systemtic Name: [(E)-1-(6-methoxy-7-methyl-4-oxidanyl-3-oxidanylidene-1H-2-benzofuran-5-yl)-6-methyl-1-phosphono-oct-6-enyl]phosphonic acid Openeye Name: [(E)-1-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-isobenzofuran-5-yl)-6-methyl-1-phosphono-oct-6-enyl]phosphonic acid CAS Name: [(E)-1-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-isobenzofuran-5-yl)-6-methyl-1-phosphonooct-6-enyl]phosphonic acid IUPAC Name: [(E)-1-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)-6-methyl-1-phosphonooct-6-enyl]phosphonic acid Traditional Name: [(E)-1-(4-hydroxy-3-keto-6-methoxy-7-methyl-phthalan-5-yl)-6-methyl-1-phosphono-oct-6-enyl]phosphonic acid Formula: C19H28O10P2 MolecularWeight: 478.367142

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Descriptors Computed from Structure

Canonical SMILES:

CC=C(C)CCCCC(C1=C(C2=C(COC2=O)C(=C1OC)C)O)(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

C/C=C(\C)/CCCCC(C1=C(C2=C(COC2=O)C(=C1OC)C)O)(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C19H28O10P2/c1-5-11(2)8-6-7-9-19(30(22,23)24,31(25,26)27)15-16(20)14-13(10-29-18(14)21)12(3)17(15)28-4/h5,20H,6-10H2,1-4H3,(H2,22,23,24)(H2,25,26,27)/b11-5+