N5-(4-methoxy-3-nitro-phenyl)pyridin-1-ium-2,5-diamine

Systemtic Name: N5-(4-methoxy-3-nitro-phenyl)pyridin-1-ium-2,5-diamine Openeye Name: N5-(4-methoxy-3-nitro-phenyl)pyridin-1-ium-2,5-diamine CAS Name: N5-(4-methoxy-3-nitrophenyl)pyridin-1-ium-2,5-diamine IUPAC Name: 5-N-(4-methoxy-3-nitrophenyl)pyridin-1-ium-2,5-diamine Traditional Name: (6-aminopyridin-1-ium-3-yl)-(4-methoxy-3-nitro-phenyl)amine Formula: C12H13N4O3+ MolecularWeight: 261.25662

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC2=C[NH+]=C(C=C2)N)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)NC2=C[NH+]=C(C=C2)N)[N+](=O)[O-]

InChI

InChI=1S/C12H12N4O3/c1-19-11-4-2-8(6-10(11)16(17)18)15-9-3-5-12(13)14-7-9/h2-7,15H,1H3,(H2,13,14)/p+1