(E)-4-methyl-2-[[2-methylpropyl(oxidanyl)phosphoryl]methyl]hept-2-enedioic acid

Systemtic Name: (E)-4-methyl-2-[[2-methylpropyl(oxidanyl)phosphoryl]methyl]hept-2-enedioic acid Openeye Name: (E)-2-[[hydroxy(isobutyl)phosphoryl]methyl]-4-methyl-hept-2-enedioic acid CAS Name: (E)-2-[[hydroxy(2-methylpropyl)phosphoryl]methyl]-4-methyl-2-heptenedioic acid IUPAC Name: (E)-2-[[hydroxy(2-methylpropyl)phosphoryl]methyl]-4-methylhept-2-enedioic acid Traditional Name: (E)-2-[[hydroxy(isobutyl)phosphoryl]methyl]-4-methyl-hept-2-enedioic acid Formula: C13H23O6P MolecularWeight: 306.291881

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CP(=O)(CC(=CC(C)CCC(=O)O)C(=O)O)O

Isomeric SMILES

CC(C)CP(=O)(C/C(=C/C(C)CCC(=O)O)/C(=O)O)O

InChI

InChI=1S/C13H23O6P/c1-9(2)7-20(18,19)8-11(13(16)17)6-10(3)4-5-12(14)15/h6,9-10H,4-5,7-8H2,1-3H3,(H,14,15)(H,16,17)(H,18,19)/b11-6-