2-[1-[oxidanyl(thiophen-3-ylmethyl)phosphoryl]ethyl]pentanedioic acid

Systemtic Name: 2-[1-[oxidanyl(thiophen-3-ylmethyl)phosphoryl]ethyl]pentanedioic acid Openeye Name: 2-[1-[hydroxy(3-thienylmethyl)phosphoryl]ethyl]pentanedioic acid CAS Name: 2-[1-[hydroxy(3-thiophenylmethyl)phosphoryl]ethyl]pentanedioic acid IUPAC Name: 2-[1-[hydroxy(thiophen-3-ylmethyl)phosphoryl]ethyl]pentanedioic acid Traditional Name: 2-[1-[hydroxy(3-thenyl)phosphoryl]ethyl]glutaric acid Formula: C12H17O6PS MolecularWeight: 320.298541

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(CCC(=O)O)C(=O)O)P(=O)(CC1=CSC=C1)O

Isomeric SMILES

CC(C(CCC(=O)O)C(=O)O)P(=O)(CC1=CSC=C1)O

InChI

InChI=1S/C12H17O6PS/c1-8(10(12(15)16)2-3-11(13)14)19(17,18)6-9-4-5-20-7-9/h4-5,7-8,10H,2-3,6H2,1H3,(H,13,14)(H,15,16)(H,17,18)