2-[[naphthalen-1-yl(oxidanyl)phosphoryl]-phenyl-methyl]pentanedioic acid

Systemtic Name: 2-[[naphthalen-1-yl(oxidanyl)phosphoryl]-phenyl-methyl]pentanedioic acid Openeye Name: 2-[[hydroxy(1-naphthyl)phosphoryl]-phenyl-methyl]pentanedioic acid CAS Name: 2-[[hydroxy(1-naphthalenyl)phosphoryl]-phenylmethyl]pentanedioic acid IUPAC Name: 2-[[hydroxy(naphthalen-1-yl)phosphoryl]-phenylmethyl]pentanedioic acid Traditional Name: 2-[[hydroxy(1-naphthyl)phosphoryl]-phenyl-methyl]glutaric acid Formula: C22H21O6P MolecularWeight: 412.372301

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(CCC(=O)O)C(=O)O)P(=O)(C2=CC=CC3=CC=CC=C32)O

Isomeric SMILES

C1=CC=C(C=C1)C(C(CCC(=O)O)C(=O)O)P(=O)(C2=CC=CC3=CC=CC=C32)O

InChI

InChI=1S/C22H21O6P/c23-20(24)14-13-18(22(25)26)21(16-8-2-1-3-9-16)29(27,28)19-12-6-10-15-7-4-5-11-17(15)19/h1-12,18,21H,13-14H2,(H,23,24)(H,25,26)(H,27,28)