N-[(4,6-dimethylpyrazolo[3,4-b]pyridin-3-ylidene)amino]azepan-1-ium-1-amine

Systemtic Name: N-[(4,6-dimethylpyrazolo[3,4-b]pyridin-3-ylidene)amino]azepan-1-ium-1-amine Openeye Name: N-[(4,6-dimethylpyrazolo[3,4-b]pyridin-3-ylidene)amino]azepan-1-ium-1-amine CAS Name: N-[(4,6-dimethyl-3-pyrazolo[3,4-b]pyridinylidene)amino]-1-azepan-1-iumamine IUPAC Name: N-[(4,6-dimethylpyrazolo[3,4-b]pyridin-3-ylidene)amino]azepan-1-ium-1-amine Traditional Name: azepan-1-ium-1-yl-[(4,6-dimethylpyrazolo[3,4-b]pyridin-3-ylidene)amino]amine Formula: C14H21N6+ MolecularWeight: 273.35674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C(=NN[NH+]3CCCCCC3)N=N2)C

Isomeric SMILES

CC1=CC(=NC2=C1C(=NN[NH+]3CCCCCC3)N=N2)C

InChI

InChI=1S/C14H20N6/c1-10-9-11(2)15-13-12(10)14(17-16-13)18-19-20-7-5-3-4-6-8-20/h9,19H,3-8H2,1-2H3/p+1