N-(2-ethylsulfanylethyl)-5-nitro-pyridin-1-ium-2-amine

Systemtic Name: N-(2-ethylsulfanylethyl)-5-nitro-pyridin-1-ium-2-amine Openeye Name: N-(2-ethylsulfanylethyl)-5-nitro-pyridin-1-ium-2-amine CAS Name: N-[2-(ethylthio)ethyl]-5-nitro-2-pyridin-1-iumamine IUPAC Name: N-(2-ethylsulfanylethyl)-5-nitropyridin-1-ium-2-amine Traditional Name: 2-(ethylthio)ethyl-(5-nitropyridin-1-ium-2-yl)amine Formula: C9H14N3O2S+ MolecularWeight: 228.29136

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Descriptors Computed from Structure

Canonical SMILES:

CCSCCNC1=[NH+]C=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CCSCCNC1=[NH+]C=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C9H13N3O2S/c1-2-15-6-5-10-9-4-3-8(7-11-9)12(13)14/h3-4,7H,2,5-6H2,1H3,(H,10,11)/p+1