4-[2-[4-(aminomethyl)-2-azanyl-phenyl]ethyl]-N'-methyl-benzenecarboximidamide trihydrochloride

Systemtic Name: 4-[2-[4-(aminomethyl)-2-azanyl-phenyl]ethyl]-N'-methyl-benzenecarboximidamide trihydrochloride Openeye Name: 4-[2-[2-amino-4-(aminomethyl)phenyl]ethyl]-N'-methyl-benzamidine trihydrochloride CAS Name: 4-[2-[2-amino-4-(aminomethyl)phenyl]ethyl]-N'-methylbenzenecarboximidamide trihydrochloride IUPAC Name: 4-[2-[2-amino-4-(aminomethyl)phenyl]ethyl]-N'-methylbenzenecarboximidamide trihydrochloride Traditional Name: 4-[2-[2-amino-4-(aminomethyl)phenyl]ethyl]-N'-methyl-benzamidine trihydrochloride Formula: C17H25Cl3N4 MolecularWeight: 391.7662

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN=C(C1=CC=C(C=C1)CCC2=C(C=C(C=C2)CN)N)N.Cl.Cl.Cl

Isomeric SMILES

CN=C(C1=CC=C(C=C1)CCC2=C(C=C(C=C2)CN)N)N.Cl.Cl.Cl

InChI

InChI=1S/C17H22N4.3ClH/c1-21-17(20)15-8-3-12(4-9-15)2-6-14-7-5-13(11-18)10-16(14)19;;;/h3-5,7-10H,2,6,11,18-19H2,1H3,(H2,20,21);3*1H