2-[[(2-methyl-1-naphthalen-2-yl-3-oxidanyl-3-oxidanylidene-propyl)-oxidanyl-phosphoryl]methyl]pentanedioic acid

Systemtic Name: 2-[[(2-methyl-1-naphthalen-2-yl-3-oxidanyl-3-oxidanylidene-propyl)-oxidanyl-phosphoryl]methyl]pentanedioic acid Openeye Name: 2-[[hydroxy-[3-hydroxy-2-methyl-1-(2-naphthyl)-3-oxo-propyl]phosphoryl]methyl]pentanedioic acid CAS Name: 2-[[hydroxy-[3-hydroxy-2-methyl-1-(2-naphthalenyl)-3-oxopropyl]phosphoryl]methyl]pentanedioic acid IUPAC Name: 2-[[hydroxy-(3-hydroxy-2-methyl-1-naphthalen-2-yl-3-oxopropyl)phosphoryl]methyl]pentanedioic acid Traditional Name: 2-[[hydroxy-[3-hydroxy-3-keto-2-methyl-1-(2-naphthyl)propyl]phosphoryl]methyl]glutaric acid Formula: C20H23O8P MolecularWeight: 422.365581

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC2=CC=CC=C2C=C1)P(=O)(CC(CCC(=O)O)C(=O)O)O)C(=O)O

Isomeric SMILES

CC(C(C1=CC2=CC=CC=C2C=C1)P(=O)(CC(CCC(=O)O)C(=O)O)O)C(=O)O

InChI

InChI=1S/C20H23O8P/c1-12(19(23)24)18(15-7-6-13-4-2-3-5-14(13)10-15)29(27,28)11-16(20(25)26)8-9-17(21)22/h2-7,10,12,16,18H,8-9,11H2,1H3,(H,21,22)(H,23,24)(H,25,26)(H,27,28)