2-(4-carbamimidoylphenyl)benzotriazole-5-carboximidamide dihydrochloride

Systemtic Name: 2-(4-carbamimidoylphenyl)benzotriazole-5-carboximidamide dihydrochloride Openeye Name: 2-(4-carbamimidoylphenyl)benzotriazole-5-carboxamidine dihydrochloride CAS Name: 2-(4-carbamimidoylphenyl)-5-benzotriazolecarboximidamide dihydrochloride IUPAC Name: 2-(4-carbamimidoylphenyl)benzotriazole-5-carboximidamide dihydrochloride Traditional Name: 2-(4-amidinophenyl)benzotriazole-5-carboxamidine dihydrochloride Formula: C14H15Cl2N7 MolecularWeight: 352.2218

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=N)N)N2N=C3C=CC(=CC3=N2)C(=N)N.Cl.Cl

Isomeric SMILES

C1=CC(=CC=C1C(=N)N)N2N=C3C=CC(=CC3=N2)C(=N)N.Cl.Cl

InChI

InChI=1S/C14H13N7.2ClH/c15-13(16)8-1-4-10(5-2-8)21-19-11-6-3-9(14(17)18)7-12(11)20-21;;/h1-7H,(H3,15,16)(H3,17,18);2*1H