4-[[methoxy-(4-nitrophenoxy)phosphinothioyl]amino]butanoic acid

Systemtic Name: 4-[[methoxy-(4-nitrophenoxy)phosphinothioyl]amino]butanoic acid Openeye Name: 4-[[methoxy-(4-nitrophenoxy)phosphinothioyl]amino]butanoic acid CAS Name: 4-[[methoxy-(4-nitrophenoxy)phosphinothioyl]amino]butanoic acid IUPAC Name: 4-[[methoxy-(4-nitrophenoxy)phosphinothioyl]amino]butanoic acid Traditional Name: 4-[[methoxy-(4-nitrophenoxy)thiophosphoryl]amino]butyric acid Formula: C11H15N2O6PS MolecularWeight: 334.285361

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Descriptors Computed from Structure

Canonical SMILES:

COP(=S)(NCCCC(=O)O)OC1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

COP(=S)(NCCCC(=O)O)OC1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C11H15N2O6PS/c1-18-20(21,12-8-2-3-11(14)15)19-10-6-4-9(5-7-10)13(16)17/h4-7H,2-3,8H2,1H3,(H,12,21)(H,14,15)