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

Systemtic Name: 2-[(E)-(3-methoxy-2,6-dinitro-phenyl)methylideneamino]-1-oxidanyl-guanidine hydrochloride Openeye Name: 1-hydroxy-2-[(E)-(3-methoxy-2,6-dinitro-phenyl)methyleneamino]guanidine hydrochloride CAS Name: 1-hydroxy-2-[(E)-(3-methoxy-2,6-dinitrophenyl)methylideneamino]guanidine hydrochloride IUPAC Name: 1-hydroxy-2-[(E)-(3-methoxy-2,6-dinitrophenyl)methylideneamino]guanidine hydrochloride Traditional Name: 1-hydroxy-2-[(E)-(3-methoxy-2,6-dinitro-benzylidene)amino]guanidine hydrochloride Formula: C9H11ClN6O6 MolecularWeight: 334.67324

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)[N+](=O)[O-])C=NN=C(N)NO)[N+](=O)[O-].Cl

Isomeric SMILES

COC1=C(C(=C(C=C1)[N+](=O)[O-])/C=N/N=C(/N)\NO)[N+](=O)[O-].Cl

InChI

InChI=1S/C9H10N6O6.ClH/c1-21-7-3-2-6(14(17)18)5(8(7)15(19)20)4-11-12-9(10)13-16;/h2-4,16H,1H3,(H3,10,12,13);1H/b11-4+;