3-[[2-(3,4-dihydro-2H-chromen-6-yl)quinolin-4-yl]amino]propane-1,2-diol

Systemtic Name: 3-[[2-(3,4-dihydro-2H-chromen-6-yl)quinolin-4-yl]amino]propane-1,2-diol Openeye Name: 3-[(2-chroman-6-yl-4-quinolyl)amino]propane-1,2-diol CAS Name: 3-[[2-(3,4-dihydro-2H-1-benzopyran-6-yl)-4-quinolinyl]amino]propane-1,2-diol IUPAC Name: 3-[[2-(3,4-dihydro-2H-chromen-6-yl)quinolin-4-yl]amino]propane-1,2-diol Traditional Name: 3-[(2-chroman-6-yl-4-quinolyl)amino]propane-1,2-diol Formula: C21H22N2O3 MolecularWeight: 350.41098

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC(=C2)C3=NC4=CC=CC=C4C(=C3)NCC(CO)O)OC1

Isomeric SMILES

C1CC2=C(C=CC(=C2)C3=NC4=CC=CC=C4C(=C3)NCC(CO)O)OC1

InChI

InChI=1S/C21H22N2O3/c24-13-16(25)12-22-20-11-19(23-18-6-2-1-5-17(18)20)14-7-8-21-15(10-14)4-3-9-26-21/h1-2,5-8,10-11,16,24-25H,3-4,9,12-13H2,(H,22,23)