2-[(3-methylphenyl)sulfanylcarbonyl-(phosphonomethyl)amino]ethanoic acid

Systemtic Name: 2-[(3-methylphenyl)sulfanylcarbonyl-(phosphonomethyl)amino]ethanoic acid Openeye Name: 2-[m-tolylsulfanylcarbonyl(phosphonomethyl)amino]acetic acid CAS Name: 2-[[[(3-methylphenyl)thio]-oxomethyl]-(phosphonomethyl)amino]acetic acid IUPAC Name: 2-[(3-methylphenyl)sulfanylcarbonyl-(phosphonomethyl)amino]acetic acid Traditional Name: 2-[(m-tolylthio)carbonyl-(phosphonomethyl)amino]acetic acid Formula: C11H14NO6PS MolecularWeight: 319.270721

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)SC(=O)N(CC(=O)O)CP(=O)(O)O

Isomeric SMILES

CC1=CC(=CC=C1)SC(=O)N(CC(=O)O)CP(=O)(O)O

InChI

InChI=1S/C11H14NO6PS/c1-8-3-2-4-9(5-8)20-11(15)12(6-10(13)14)7-19(16,17)18/h2-5H,6-7H2,1H3,(H,13,14)(H2,16,17,18)