N4-(3-imidazol-1-ylpropyl)-2-methyl-benzene-1,4-diamine trihydrochloride

Systemtic Name: N4-(3-imidazol-1-ylpropyl)-2-methyl-benzene-1,4-diamine trihydrochloride Openeye Name: N4-(3-imidazol-1-ylpropyl)-2-methyl-benzene-1,4-diamine trihydrochloride CAS Name: N4-[3-(1-imidazolyl)propyl]-2-methylbenzene-1,4-diamine trihydrochloride IUPAC Name: 4-N-(3-imidazol-1-ylpropyl)-2-methylbenzene-1,4-diamine trihydrochloride Traditional Name: (4-amino-3-methyl-phenyl)-(3-imidazol-1-ylpropyl)amine trihydrochloride Formula: C13H21Cl3N4 MolecularWeight: 339.69164

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NCCCN2C=CN=C2)N.Cl.Cl.Cl

Isomeric SMILES

CC1=C(C=CC(=C1)NCCCN2C=CN=C2)N.Cl.Cl.Cl

InChI

InChI=1S/C13H18N4.3ClH/c1-11-9-12(3-4-13(11)14)16-5-2-7-17-8-6-15-10-17;;;/h3-4,6,8-10,16H,2,5,7,14H2,1H3;3*1H