2-[(Z)-[1-(4-nitrophenyl)-2-pyridin-1-ium-1-yl-ethylidene]amino]guanidine bromide

Systemtic Name: 2-[(Z)-[1-(4-nitrophenyl)-2-pyridin-1-ium-1-yl-ethylidene]amino]guanidine bromide Openeye Name: 2-[(Z)-[1-(4-nitrophenyl)-2-pyridin-1-ium-1-yl-ethylidene]amino]guanidine bromide CAS Name: 2-[(Z)-[1-(4-nitrophenyl)-2-(1-pyridin-1-iumyl)ethylidene]amino]guanidine bromide IUPAC Name: 2-[(Z)-[1-(4-nitrophenyl)-2-pyridin-1-ium-1-ylethylidene]amino]guanidine bromide Traditional Name: 2-[(Z)-[1-(4-nitrophenyl)-2-pyridin-1-ium-1-yl-ethylidene]amino]guanidine bromide Formula: C14H15BrN6O2 MolecularWeight: 379.2119

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C=C1)CC(=NN=C(N)N)C2=CC=C(C=C2)[N+](=O)[O-].[Br-]

Isomeric SMILES

C1=CC=[N+](C=C1)C/C(=N\N=C(N)N)/C2=CC=C(C=C2)[N+](=O)[O-].[Br-]

InChI

InChI=1S/C14H15N6O2.BrH/c15-14(16)18-17-13(10-19-8-2-1-3-9-19)11-4-6-12(7-5-11)20(21)22;/h1-9H,10H2,(H4,15,16,18);1H/q+1;/p-1/b17-13+;