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

Systemtic Name: 3-[[2-(3-chloranyl-4-methyl-phenyl)quinolin-4-yl]amino]propane-1,2-diol hydrochloride Openeye Name: 3-[[2-(3-chloro-4-methyl-phenyl)-4-quinolyl]amino]propane-1,2-diol hydrochloride CAS Name: 3-[[2-(3-chloro-4-methylphenyl)-4-quinolinyl]amino]propane-1,2-diol hydrochloride IUPAC Name: 3-[[2-(3-chloro-4-methylphenyl)quinolin-4-yl]amino]propane-1,2-diol hydrochloride Traditional Name: 3-[[2-(3-chloro-4-methyl-phenyl)-4-quinolyl]amino]propane-1,2-diol hydrochloride Formula: C19H20Cl2N2O2 MolecularWeight: 379.2803

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NC3=CC=CC=C3C(=C2)NCC(CO)O)Cl.Cl

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NC3=CC=CC=C3C(=C2)NCC(CO)O)Cl.Cl

InChI

InChI=1S/C19H19ClN2O2.ClH/c1-12-6-7-13(8-16(12)20)18-9-19(21-10-14(24)11-23)15-4-2-3-5-17(15)22-18;/h2-9,14,23-24H,10-11H2,1H3,(H,21,22);1H