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

Systemtic Name: 2-[[[3-methoxy-3-oxidanylidene-2-(phenylmethyl)propyl]-oxidanyl-phosphoryl]methyl]pentanedioic acid Openeye Name: 2-[[(2-benzyl-3-methoxy-3-oxo-propyl)-hydroxy-phosphoryl]methyl]pentanedioic acid CAS Name: 2-[[hydroxy-[3-methoxy-3-oxo-2-(phenylmethyl)propyl]phosphoryl]methyl]pentanedioic acid IUPAC Name: 2-[[(2-benzyl-3-methoxy-3-oxopropyl)-hydroxyphosphoryl]methyl]pentanedioic acid Traditional Name: 2-[[(2-benzyl-3-keto-3-methoxy-propyl)-hydroxy-phosphoryl]methyl]glutaric acid Formula: C17H23O8P MolecularWeight: 386.333481

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)CP(=O)(CC(CCC(=O)O)C(=O)O)O

Isomeric SMILES

COC(=O)C(CC1=CC=CC=C1)CP(=O)(CC(CCC(=O)O)C(=O)O)O

InChI

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