2-[[oxidanyl-(phenylmethyl)phosphoryl]methyl]hexanedioic acid

Systemtic Name: 2-[[oxidanyl-(phenylmethyl)phosphoryl]methyl]hexanedioic acid Openeye Name: 2-[[benzyl(hydroxy)phosphoryl]methyl]hexanedioic acid CAS Name: 2-[[hydroxy-(phenylmethyl)phosphoryl]methyl]hexanedioic acid IUPAC Name: 2-[[benzyl(hydroxy)phosphoryl]methyl]hexanedioic acid Traditional Name: 2-[[benzyl(hydroxy)phosphoryl]methyl]adipic acid Formula: C14H19O6P MolecularWeight: 314.270821

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CP(=O)(CC(CCCC(=O)O)C(=O)O)O

Isomeric SMILES

C1=CC=C(C=C1)CP(=O)(CC(CCCC(=O)O)C(=O)O)O

InChI

InChI=1S/C14H19O6P/c15-13(16)8-4-7-12(14(17)18)10-21(19,20)9-11-5-2-1-3-6-11/h1-3,5-6,12H,4,7-10H2,(H,15,16)(H,17,18)(H,19,20)