N4-[3-(2-methylphenyl)isoquinolin-1-yl]cyclohexane-1,4-diamine hydrochloride

Systemtic Name: N4-[3-(2-methylphenyl)isoquinolin-1-yl]cyclohexane-1,4-diamine hydrochloride Openeye Name: N4-[3-(o-tolyl)-1-isoquinolyl]cyclohexane-1,4-diamine hydrochloride CAS Name: N4-[3-(2-methylphenyl)-1-isoquinolinyl]cyclohexane-1,4-diamine hydrochloride IUPAC Name: 4-N-[3-(2-methylphenyl)isoquinolin-1-yl]cyclohexane-1,4-diamine hydrochloride Traditional Name: (4-aminocyclohexyl)-[3-(o-tolyl)-1-isoquinolyl]amine hydrochloride Formula: C22H26ClN3 MolecularWeight: 367.91494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=CC3=CC=CC=C3C(=N2)NC4CCC(CC4)N.Cl

Isomeric SMILES

CC1=CC=CC=C1C2=CC3=CC=CC=C3C(=N2)NC4CCC(CC4)N.Cl

InChI

InChI=1S/C22H25N3.ClH/c1-15-6-2-4-8-19(15)21-14-16-7-3-5-9-20(16)22(25-21)24-18-12-10-17(23)11-13-18;/h2-9,14,17-18H,10-13,23H2,1H3,(H,24,25);1H