1-[bis(azanyl)methylidene]-2-(6,7-dimethoxy-1-methyl-isoquinolin-2-ium-2-yl)guanidine chloride

Systemtic Name: 1-[bis(azanyl)methylidene]-2-(6,7-dimethoxy-1-methyl-isoquinolin-2-ium-2-yl)guanidine chloride Openeye Name: 1-(diaminomethylene)-2-(6,7-dimethoxy-1-methyl-isoquinolin-2-ium-2-yl)guanidine chloride CAS Name: 1-(diaminomethylidene)-2-(6,7-dimethoxy-1-methyl-2-isoquinolin-2-iumyl)guanidine chloride IUPAC Name: 1-(diaminomethylidene)-2-(6,7-dimethoxy-1-methylisoquinolin-2-ium-2-yl)guanidine chloride Traditional Name: 1-(diaminomethylene)-2-(6,7-dimethoxy-1-methyl-isoquinolin-2-ium-2-yl)guanidine chloride Formula: C14H19ClN6O2 MolecularWeight: 338.79266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C=CC2=CC(=C(C=C12)OC)OC)N=C(N)N=C(N)N.[Cl-]

Isomeric SMILES

CC1=[N+](C=CC2=CC(=C(C=C12)OC)OC)/N=C(\N)/N=C(N)N.[Cl-]

InChI

InChI=1S/C14H19N6O2.ClH/c1-8-10-7-12(22-3)11(21-2)6-9(10)4-5-20(8)19-14(17)18-13(15)16;/h4-7H,1-3H3,(H6,15,16,17,18,19);1H/q+1;/p-1