2-[(E)-(2,3-dimethoxy-5-nitro-phenyl)methylideneamino]guanidine; ethanoic acid

Systemtic Name: 2-[(E)-(2,3-dimethoxy-5-nitro-phenyl)methylideneamino]guanidine; ethanoic acid Openeye Name: acetic acid; 2-[(E)-(2,3-dimethoxy-5-nitro-phenyl)methyleneamino]guanidine CAS Name: acetic acid; 2-[(E)-(2,3-dimethoxy-5-nitrophenyl)methylideneamino]guanidine IUPAC Name: acetic acid; 2-[(E)-(2,3-dimethoxy-5-nitrophenyl)methylideneamino]guanidine Traditional Name: acetic acid; 2-[(E)-(2,3-dimethoxy-5-nitro-benzylidene)amino]guanidine Formula: C12H17N5O6 MolecularWeight: 327.29328

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)O.COC1=C(C(=CC(=C1)[N+](=O)[O-])C=NN=C(N)N)OC

Isomeric SMILES

CC(=O)O.COC1=C(C(=CC(=C1)[N+](=O)[O-])/C=N/N=C(N)N)OC

InChI

InChI=1S/C10H13N5O4.C2H4O2/c1-18-8-4-7(15(16)17)3-6(9(8)19-2)5-13-14-10(11)12;1-2(3)4/h3-5H,1-2H3,(H4,11,12,14);1H3,(H,3,4)/b13-5+;