[(2-ethoxy-2-oxidanylidene-ethyl)-(phenylmethylsulfanyl)carbonyl-amino]methylphosphonic acid

Systemtic Name: [(2-ethoxy-2-oxidanylidene-ethyl)-(phenylmethylsulfanyl)carbonyl-amino]methylphosphonic acid Openeye Name: [benzylsulfanylcarbonyl-(2-ethoxy-2-oxo-ethyl)amino]methylphosphonic acid CAS Name: [(2-ethoxy-2-oxoethyl)-[oxo-(phenylmethylthio)methyl]amino]methylphosphonic acid IUPAC Name: [benzylsulfanylcarbonyl-(2-ethoxy-2-oxoethyl)amino]methylphosphonic acid Traditional Name: [(benzylthio)carbonyl-(2-ethoxy-2-keto-ethyl)amino]methylphosphonic acid Formula: C13H18NO6PS MolecularWeight: 347.323881

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN(CP(=O)(O)O)C(=O)SCC1=CC=CC=C1

Isomeric SMILES

CCOC(=O)CN(CP(=O)(O)O)C(=O)SCC1=CC=CC=C1

InChI

InChI=1S/C13H18NO6PS/c1-2-20-12(15)8-14(10-21(17,18)19)13(16)22-9-11-6-4-3-5-7-11/h3-7H,2,8-10H2,1H3,(H2,17,18,19)