2-[[oxidanyl(1-phenylethyl)phosphoryl]methyl]pentanedioic acid

Systemtic Name: 2-[[oxidanyl(1-phenylethyl)phosphoryl]methyl]pentanedioic acid Openeye Name: 2-[[hydroxy(1-phenylethyl)phosphoryl]methyl]pentanedioic acid CAS Name: 2-[[hydroxy(1-phenylethyl)phosphoryl]methyl]pentanedioic acid IUPAC Name: 2-[[hydroxy(1-phenylethyl)phosphoryl]methyl]pentanedioic acid Traditional Name: 2-[[hydroxy(1-phenylethyl)phosphoryl]methyl]glutaric acid Formula: C14H19O6P MolecularWeight: 314.270821

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19O6P/c1-10(11-5-3-2-4-6-11)21(19,20)9-12(14(17)18)7-8-13(15)16/h2-6,10,12H,7-9H2,1H3,(H,15,16)(H,17,18)(H,19,20)