2-[bis(2-hydroxyethyl)azaniumyl]-N-(5-nitro-1,3-thiazol-2-yl)ethanimidate

Systemtic Name: 2-[bis(2-hydroxyethyl)azaniumyl]-N-(5-nitro-1,3-thiazol-2-yl)ethanimidate Openeye Name: 2-[bis(2-hydroxyethyl)ammonio]-N-(5-nitrothiazol-2-yl)ethanimidate CAS Name: 2-[bis(2-hydroxyethyl)ammonio]-N-(5-nitro-2-thiazolyl)ethanimidate IUPAC Name: 2-[bis(2-hydroxyethyl)azaniumyl]-N-(5-nitro-1,3-thiazol-2-yl)ethanimidate Traditional Name: 2-[bis(2-hydroxyethyl)ammonio]-N-(5-nitrothiazol-2-yl)acetimidate Formula: C9H14N4O5S MolecularWeight: 290.29626

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(SC(=N1)N=C(C[NH+](CCO)CCO)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=C(SC(=N1)N=C(C[NH+](CCO)CCO)[O-])[N+](=O)[O-]

InChI

InChI=1S/C9H14N4O5S/c14-3-1-12(2-4-15)6-7(16)11-9-10-5-8(19-9)13(17)18/h5,14-15H,1-4,6H2,(H,10,11,16)