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3-[oxidanyl-(phenylmethyl)phosphoryl]-2-thiophen-3-yl-octanoic acid

3-[oxidanyl-(phenylmethyl)phosphoryl]-2-thiophen-3-yl-octanoic acid

Systemtic Name:3-[oxidanyl-(phenylmethyl)phosphoryl]-2-thiophen-3-yl-octanoic acid
Openeye Name:3-[benzyl(hydroxy)phosphoryl]-2-(3-thienyl)octanoic acid
CAS Name:3-[hydroxy-(phenylmethyl)phosphoryl]-2-(3-thiophenyl)octanoic acid
IUPAC Name:3-[benzyl(hydroxy)phosphoryl]-2-thiophen-3-yloctanoic acid
Traditional Name:3-[benzyl(hydroxy)phosphoryl]-2-(3-thienyl)caprylic acid
Formula: C19H25O4PS
MolecularWeight: 380.438161
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C(C1=CSC=C1)C(=O)O)P(=O)(CC2=CC=CC=C2)O


Isomeric SMILES

CCCCCC(C(C1=CSC=C1)C(=O)O)P(=O)(CC2=CC=CC=C2)O


InChI

InChI=1S/C19H25O4PS/c1-2-3-5-10-17(18(19(20)21)16-11-12-25-14-16)24(22,23)13-15-8-6-4-7-9-15/h4,6-9,11-12,14,17-18H,2-3,5,10,13H2,1H3,(H,20,21)(H,22,23)


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