[ethyl(propan-2-ylsulfanyl)phosphoryl] (1E)-N-methoxy-4-nitro-benzenecarboximidate

Systemtic Name: [ethyl(propan-2-ylsulfanyl)phosphoryl] (1E)-N-methoxy-4-nitro-benzenecarboximidate Openeye Name: [ethyl(isopropylsulfanyl)phosphoryl] (1E)-N-methoxy-4-nitro-benzenecarboximidate CAS Name: (1E)-N-methoxy-4-nitrobenzenecarboximidic acid [ethyl-(propan-2-ylthio)phosphoryl] ester IUPAC Name: [ethyl(propan-2-ylsulfanyl)phosphoryl] (1E)-N-methoxy-4-nitrobenzenecarboximidate Traditional Name: (1E)-N-methoxy-4-nitro-benzenecarboximidic acid [ethyl-(isopropylthio)phosphoryl] ester Formula: C13H19N2O5PS MolecularWeight: 346.339121

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Descriptors Computed from Structure

Canonical SMILES:

CCP(=O)(OC(=NOC)C1=CC=C(C=C1)[N+](=O)[O-])SC(C)C

Isomeric SMILES

CCP(=O)(O/C(=N/OC)/C1=CC=C(C=C1)[N+](=O)[O-])SC(C)C

InChI

InChI=1S/C13H19N2O5PS/c1-5-21(18,22-10(2)3)20-13(14-19-4)11-6-8-12(9-7-11)15(16)17/h6-10H,5H2,1-4H3/b14-13+