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

Systemtic Name: [(E)-1-(6-methoxy-7-methyl-4-oxidanyl-3-oxidanylidene-1H-2-benzofuran-5-yl)-3-methyl-1-phosphono-pent-3-enyl]phosphonic acid Openeye Name: [(E)-1-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-isobenzofuran-5-yl)-3-methyl-1-phosphono-pent-3-enyl]phosphonic acid CAS Name: [(E)-1-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-isobenzofuran-5-yl)-3-methyl-1-phosphonopent-3-enyl]phosphonic acid IUPAC Name: [(E)-1-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)-3-methyl-1-phosphonopent-3-enyl]phosphonic acid Traditional Name: [(E)-1-(4-hydroxy-3-keto-6-methoxy-7-methyl-phthalan-5-yl)-3-methyl-1-phosphono-pent-3-enyl]phosphonic acid Formula: C16H22O10P2 MolecularWeight: 436.287402

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22O10P2/c1-5-8(2)6-16(27(19,20)21,28(22,23)24)12-13(17)11-10(7-26-15(11)18)9(3)14(12)25-4/h5,17H,6-7H2,1-4H3,(H2,19,20,21)(H2,22,23,24)/b8-5+