2-[[(2-methyl-3-oxidanylidene-3-phenylmethoxy-propyl)-oxidanyl-phosphoryl]methyl]pentanedioic acid

Systemtic Name: 2-[[(2-methyl-3-oxidanylidene-3-phenylmethoxy-propyl)-oxidanyl-phosphoryl]methyl]pentanedioic acid Openeye Name: 2-[[(3-benzyloxy-2-methyl-3-oxo-propyl)-hydroxy-phosphoryl]methyl]pentanedioic acid CAS Name: 2-[[hydroxy-(2-methyl-3-oxo-3-phenylmethoxypropyl)phosphoryl]methyl]pentanedioic acid IUPAC Name: 2-[[hydroxy-(2-methyl-3-oxo-3-phenylmethoxypropyl)phosphoryl]methyl]pentanedioic acid Traditional Name: 2-[[(3-benzoxy-3-keto-2-methyl-propyl)-hydroxy-phosphoryl]methyl]glutaric acid Formula: C17H23O8P MolecularWeight: 386.333481

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Descriptors Computed from Structure

Canonical SMILES:

CC(CP(=O)(CC(CCC(=O)O)C(=O)O)O)C(=O)OCC1=CC=CC=C1

Isomeric SMILES

CC(CP(=O)(CC(CCC(=O)O)C(=O)O)O)C(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C17H23O8P/c1-12(17(22)25-9-13-5-3-2-4-6-13)10-26(23,24)11-14(16(20)21)7-8-15(18)19/h2-6,12,14H,7-11H2,1H3,(H,18,19)(H,20,21)(H,23,24)