4-[(7-chloranylquinolin-4-yl)amino]-2-[(dipentylamino)methyl]phenol dihydrochloride

Systemtic Name: 4-[(7-chloranylquinolin-4-yl)amino]-2-[(dipentylamino)methyl]phenol dihydrochloride Openeye Name: 4-[(7-chloro-4-quinolyl)amino]-2-[(dipentylamino)methyl]phenol dihydrochloride CAS Name: 4-[(7-chloro-4-quinolinyl)amino]-2-[(dipentylamino)methyl]phenol dihydrochloride IUPAC Name: 4-[(7-chloroquinolin-4-yl)amino]-2-[(dipentylamino)methyl]phenol dihydrochloride Traditional Name: 4-[(7-chloro-4-quinolyl)amino]-2-[(diamylamino)methyl]phenol dihydrochloride Formula: C26H36Cl3N3O MolecularWeight: 512.94254

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CCCCC)CC1=C(C=CC(=C1)NC2=C3C=CC(=CC3=NC=C2)Cl)O.Cl.Cl

Isomeric SMILES

CCCCCN(CCCCC)CC1=C(C=CC(=C1)NC2=C3C=CC(=CC3=NC=C2)Cl)O.Cl.Cl

InChI

InChI=1S/C26H34ClN3O.2ClH/c1-3-5-7-15-30(16-8-6-4-2)19-20-17-22(10-12-26(20)31)29-24-13-14-28-25-18-21(27)9-11-23(24)25;;/h9-14,17-18,31H,3-8,15-16,19H2,1-2H3,(H,28,29);2*1H