2-[(E)-4-(1,3-benzodioxol-5-yl)butan-2-ylideneamino]guanidine; nitric acid

Systemtic Name: 2-[(E)-4-(1,3-benzodioxol-5-yl)butan-2-ylideneamino]guanidine; nitric acid Openeye Name: 2-[(E)-[3-(1,3-benzodioxol-5-yl)-1-methyl-propylidene]amino]guanidine; nitric acid CAS Name: 2-[(E)-4-(1,3-benzodioxol-5-yl)butan-2-ylideneamino]guanidine; nitric acid IUPAC Name: 2-[(E)-4-(1,3-benzodioxol-5-yl)butan-2-ylideneamino]guanidine; nitric acid Traditional Name: 2-[(E)-[3-(1,3-benzodioxol-5-yl)-1-methyl-propylidene]amino]guanidine; nitric acid Formula: C12H17N5O5 MolecularWeight: 311.29388

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NN=C(N)N)CCC1=CC2=C(C=C1)OCO2.[N+](=O)(O)[O-]

Isomeric SMILES

C/C(=N\N=C(N)N)/CCC1=CC2=C(C=C1)OCO2.[N+](=O)(O)[O-]

InChI

InChI=1S/C12H16N4O2.HNO3/c1-8(15-16-12(13)14)2-3-9-4-5-10-11(6-9)18-7-17-10;2-1(3)4/h4-6H,2-3,7H2,1H3,(H4,13,14,16);(H,2,3,4)/b15-8+;