2-[6-(7-chloranylquinolin-4-yl)hexyl]-1,3-diphenyl-guanidine hydrochloride

Systemtic Name: 2-[6-(7-chloranylquinolin-4-yl)hexyl]-1,3-diphenyl-guanidine hydrochloride Openeye Name: 2-[6-(7-chloro-4-quinolyl)hexyl]-1,3-diphenyl-guanidine hydrochloride CAS Name: 2-[6-(7-chloro-4-quinolinyl)hexyl]-1,3-diphenylguanidine hydrochloride IUPAC Name: 2-[6-(7-chloroquinolin-4-yl)hexyl]-1,3-diphenylguanidine hydrochloride Traditional Name: 2-[6-(7-chloro-4-quinolyl)hexyl]-1,3-diphenyl-guanidine hydrochloride Formula: C28H30Cl2N4 MolecularWeight: 493.4706

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=NCCCCCCC2=C3C=CC(=CC3=NC=C2)Cl)NC4=CC=CC=C4.Cl

Isomeric SMILES

C1=CC=C(C=C1)NC(=NCCCCCCC2=C3C=CC(=CC3=NC=C2)Cl)NC4=CC=CC=C4.Cl

InChI

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