4-[(7-chloranylquinolin-4-yl)amino]-2-[(4-phenylpiperazin-1-yl)methyl]phenol trihydrochloride

Systemtic Name: 4-[(7-chloranylquinolin-4-yl)amino]-2-[(4-phenylpiperazin-1-yl)methyl]phenol trihydrochloride Openeye Name: 4-[(7-chloro-4-quinolyl)amino]-2-[(4-phenylpiperazin-1-yl)methyl]phenol trihydrochloride CAS Name: 4-[(7-chloro-4-quinolinyl)amino]-2-[(4-phenyl-1-piperazinyl)methyl]phenol trihydrochloride IUPAC Name: 4-[(7-chloroquinolin-4-yl)amino]-2-[(4-phenylpiperazin-1-yl)methyl]phenol trihydrochloride Traditional Name: 4-[(7-chloro-4-quinolyl)amino]-2-[(4-phenylpiperazino)methyl]phenol trihydrochloride Formula: C26H28Cl4N4O MolecularWeight: 554.33872

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=C(C=CC(=C2)NC3=C4C=CC(=CC4=NC=C3)Cl)O)C5=CC=CC=C5.Cl.Cl.Cl

Isomeric SMILES

C1CN(CCN1CC2=C(C=CC(=C2)NC3=C4C=CC(=CC4=NC=C3)Cl)O)C5=CC=CC=C5.Cl.Cl.Cl

InChI

InChI=1S/C26H25ClN4O.3ClH/c27-20-6-8-23-24(10-11-28-25(23)17-20)29-21-7-9-26(32)19(16-21)18-30-12-14-31(15-13-30)22-4-2-1-3-5-22;;;/h1-11,16-17,32H,12-15,18H2,(H,28,29);3*1H