2-[[(3-methylphenyl)-oxidanyl-phosphoryl]methyl]pentanedioic acid

Systemtic Name: 2-[[(3-methylphenyl)-oxidanyl-phosphoryl]methyl]pentanedioic acid Openeye Name: 2-[[hydroxy(m-tolyl)phosphoryl]methyl]pentanedioic acid CAS Name: 2-[[hydroxy-(3-methylphenyl)phosphoryl]methyl]pentanedioic acid IUPAC Name: 2-[[hydroxy-(3-methylphenyl)phosphoryl]methyl]pentanedioic acid Traditional Name: 2-[[hydroxy(m-tolyl)phosphoryl]methyl]glutaric acid Formula: C13H17O6P MolecularWeight: 300.244241

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)P(=O)(CC(CCC(=O)O)C(=O)O)O

Isomeric SMILES

CC1=CC(=CC=C1)P(=O)(CC(CCC(=O)O)C(=O)O)O

InChI

InChI=1S/C13H17O6P/c1-9-3-2-4-11(7-9)20(18,19)8-10(13(16)17)5-6-12(14)15/h2-4,7,10H,5-6,8H2,1H3,(H,14,15)(H,16,17)(H,18,19)