3-[[2-(1,3-dihydroisoindol-2-yl)quinolin-4-yl]amino]propane-1,2-diol hydrochloride

Systemtic Name: 3-[[2-(1,3-dihydroisoindol-2-yl)quinolin-4-yl]amino]propane-1,2-diol hydrochloride Openeye Name: 3-[(2-isoindolin-2-yl-4-quinolyl)amino]propane-1,2-diol hydrochloride CAS Name: 3-[[2-(1,3-dihydroisoindol-2-yl)-4-quinolinyl]amino]propane-1,2-diol hydrochloride IUPAC Name: 3-[[2-(1,3-dihydroisoindol-2-yl)quinolin-4-yl]amino]propane-1,2-diol hydrochloride Traditional Name: 3-[(2-isoindolin-2-yl-4-quinolyl)amino]propane-1,2-diol hydrochloride Formula: C20H22ClN3O2 MolecularWeight: 371.86058

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2CN1C3=NC4=CC=CC=C4C(=C3)NCC(CO)O.Cl

Isomeric SMILES

C1C2=CC=CC=C2CN1C3=NC4=CC=CC=C4C(=C3)NCC(CO)O.Cl

InChI

InChI=1S/C20H21N3O2.ClH/c24-13-16(25)10-21-19-9-20(22-18-8-4-3-7-17(18)19)23-11-14-5-1-2-6-15(14)12-23;/h1-9,16,24-25H,10-13H2,(H,21,22);1H