2-[6-(7-chloranylquinolin-2-yl)hexyl]-1,3-diphenyl-guanidine trihydrochloride

Systemtic Name: 2-[6-(7-chloranylquinolin-2-yl)hexyl]-1,3-diphenyl-guanidine trihydrochloride Openeye Name: 2-[6-(7-chloro-2-quinolyl)hexyl]-1,3-diphenyl-guanidine trihydrochloride CAS Name: 2-[6-(7-chloro-2-quinolinyl)hexyl]-1,3-diphenylguanidine trihydrochloride IUPAC Name: 2-[6-(7-chloroquinolin-2-yl)hexyl]-1,3-diphenylguanidine trihydrochloride Traditional Name: 2-[6-(7-chloro-2-quinolyl)hexyl]-1,3-diphenyl-guanidine trihydrochloride Formula: C28H32Cl4N4 MolecularWeight: 566.39248

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=NCCCCCCC2=NC3=C(C=CC(=C3)Cl)C=C2)NC4=CC=CC=C4.Cl.Cl.Cl

Isomeric SMILES

C1=CC=C(C=C1)NC(=NCCCCCCC2=NC3=C(C=CC(=C3)Cl)C=C2)NC4=CC=CC=C4.Cl.Cl.Cl

InChI

InChI=1S/C28H29ClN4.3ClH/c29-23-18-16-22-17-19-26(31-27(22)21-23)15-5-1-2-10-20-30-28(32-24-11-6-3-7-12-24)33-25-13-8-4-9-14-25;;;/h3-4,6-9,11-14,16-19,21H,1-2,5,10,15,20H2,(H2,30,32,33);3*1H