2-(1,3-dihydroisoindol-2-yl)-1-(quinolin-4-ylamino)propane-1,2-diol hydrochloride

Systemtic Name: 2-(1,3-dihydroisoindol-2-yl)-1-(quinolin-4-ylamino)propane-1,2-diol hydrochloride Openeye Name: 2-isoindolin-2-yl-1-(4-quinolylamino)propane-1,2-diol hydrochloride CAS Name: 2-(1,3-dihydroisoindol-2-yl)-1-(4-quinolinylamino)propane-1,2-diol hydrochloride IUPAC Name: 2-(1,3-dihydroisoindol-2-yl)-1-(quinolin-4-ylamino)propane-1,2-diol hydrochloride Traditional Name: 2-isoindolin-2-yl-1-(4-quinolylamino)propane-1,2-diol hydrochloride Formula: C20H22ClN3O2 MolecularWeight: 371.86058

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(NC1=CC=NC2=CC=CC=C21)O)(N3CC4=CC=CC=C4C3)O.Cl

Isomeric SMILES

CC(C(NC1=CC=NC2=CC=CC=C21)O)(N3CC4=CC=CC=C4C3)O.Cl

InChI

InChI=1S/C20H21N3O2.ClH/c1-20(25,23-12-14-6-2-3-7-15(14)13-23)19(24)22-18-10-11-21-17-9-5-4-8-16(17)18;/h2-11,19,24-25H,12-13H2,1H3,(H,21,22);1H