3-[1-(3-nonyl-1-sulfanyl-pentadecoxy)propoxy]-2-oxidanyl-2-phosphoroso-propanoic acid

Systemtic Name: 3-[1-(3-nonyl-1-sulfanyl-pentadecoxy)propoxy]-2-oxidanyl-2-phosphoroso-propanoic acid Openeye Name: 2-hydroxy-3-[1-(3-nonyl-1-sulfanyl-pentadecoxy)propoxy]-2-phosphoroso-propanoic acid CAS Name: 2-hydroxy-3-[1-(1-mercapto-3-nonylpentadecoxy)propoxy]-2-phosphorosopropanoic acid IUPAC Name: 2-hydroxy-3-[1-(3-nonyl-1-sulfanylpentadecoxy)propoxy]-2-phosphorosopropanoic acid Traditional Name: 2-hydroxy-3-[1-(1-mercapto-3-nonyl-pentadecoxy)propoxy]-2-phosphoroso-propionic acid Formula: C30H59O6PS MolecularWeight: 578.824621

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(CCCCCCCCC)CC(OC(CC)OCC(C(=O)O)(O)P=O)S

Isomeric SMILES

CCCCCCCCCCCCC(CCCCCCCCC)CC(OC(CC)OCC(C(=O)O)(O)P=O)S

InChI

InChI=1S/C30H59O6PS/c1-4-7-9-11-13-14-15-17-19-21-23-26(22-20-18-16-12-10-8-5-2)24-28(38)36-27(6-3)35-25-30(33,37-34)29(31)32/h26-28,33,38H,4-25H2,1-3H3,(H,31,32)