2-[(E)-(3-bromanyl-2,6-dinitro-phenyl)methylideneamino]-1-oxidanyl-guanidine hydrochloride

Systemtic Name: 2-[(E)-(3-bromanyl-2,6-dinitro-phenyl)methylideneamino]-1-oxidanyl-guanidine hydrochloride Openeye Name: 2-[(E)-(3-bromo-2,6-dinitro-phenyl)methyleneamino]-1-hydroxy-guanidine hydrochloride CAS Name: 2-[(E)-(3-bromo-2,6-dinitrophenyl)methylideneamino]-1-hydroxyguanidine hydrochloride IUPAC Name: 2-[(E)-(3-bromo-2,6-dinitrophenyl)methylideneamino]-1-hydroxyguanidine hydrochloride Traditional Name: 2-[(E)-(3-bromo-2,6-dinitro-benzylidene)amino]-1-hydroxy-guanidine hydrochloride Formula: C8H8BrClN6O5 MolecularWeight: 383.54332

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1[N+](=O)[O-])C=NN=C(N)NO)[N+](=O)[O-])Br.Cl

Isomeric SMILES

C1=CC(=C(C(=C1[N+](=O)[O-])/C=N/N=C(/N)\NO)[N+](=O)[O-])Br.Cl

InChI

InChI=1S/C8H7BrN6O5.ClH/c9-5-1-2-6(14(17)18)4(7(5)15(19)20)3-11-12-8(10)13-16;/h1-3,16H,(H3,10,12,13);1H/b11-3+;