4-[(7-chloranylquinolin-4-yl)amino]-2-(piperazin-1-ylmethyl)phenol trihydrochloride

Systemtic Name: 4-[(7-chloranylquinolin-4-yl)amino]-2-(piperazin-1-ylmethyl)phenol trihydrochloride Openeye Name: 4-[(7-chloro-4-quinolyl)amino]-2-(piperazin-1-ylmethyl)phenol trihydrochloride CAS Name: 4-[(7-chloro-4-quinolinyl)amino]-2-(1-piperazinylmethyl)phenol trihydrochloride IUPAC Name: 4-[(7-chloroquinolin-4-yl)amino]-2-(piperazin-1-ylmethyl)phenol trihydrochloride Traditional Name: 4-[(7-chloro-4-quinolyl)amino]-2-(piperazinomethyl)phenol trihydrochloride Formula: C20H24Cl4N4O MolecularWeight: 478.24276

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)CC2=C(C=CC(=C2)NC3=C4C=CC(=CC4=NC=C3)Cl)O.Cl.Cl.Cl

Isomeric SMILES

C1CN(CCN1)CC2=C(C=CC(=C2)NC3=C4C=CC(=CC4=NC=C3)Cl)O.Cl.Cl.Cl

InChI

InChI=1S/C20H21ClN4O.3ClH/c21-15-1-3-17-18(5-6-23-19(17)12-15)24-16-2-4-20(26)14(11-16)13-25-9-7-22-8-10-25;;;/h1-6,11-12,22,26H,7-10,13H2,(H,23,24);3*1H