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

Systemtic Name: 2-[[oxidanyl(thiophen-2-yl)phosphoryl]-phenyl-methyl]pentanedioic acid Openeye Name: 2-[[hydroxy(2-thienyl)phosphoryl]-phenyl-methyl]pentanedioic acid CAS Name: 2-[[hydroxy(thiophen-2-yl)phosphoryl]-phenylmethyl]pentanedioic acid IUPAC Name: 2-[[hydroxy(thiophen-2-yl)phosphoryl]-phenylmethyl]pentanedioic acid Traditional Name: 2-[[hydroxy(2-thienyl)phosphoryl]-phenyl-methyl]glutaric acid Formula: C16H17O6PS MolecularWeight: 368.341341

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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=CS2)O

Isomeric SMILES

C1=CC=C(C=C1)C(C(CCC(=O)O)C(=O)O)P(=O)(C2=CC=CS2)O

InChI

InChI=1S/C16H17O6PS/c17-13(18)9-8-12(16(19)20)15(11-5-2-1-3-6-11)23(21,22)14-7-4-10-24-14/h1-7,10,12,15H,8-9H2,(H,17,18)(H,19,20)(H,21,22)