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

Systemtic Name: 3-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)quinolin-4-yl]amino]propane-1,1-diol Openeye Name: 3-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-4-quinolyl]amino]propane-1,1-diol CAS Name: 3-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-4-quinolinyl]amino]propane-1,1-diol IUPAC Name: 3-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)quinolin-4-yl]amino]propane-1,1-diol Traditional Name: 3-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-4-quinolyl]amino]propane-1,1-diol Formula: C21H23N3O2 MolecularWeight: 349.42622

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C3=NC4=CC=CC=C4C(=C3)NCCC(O)O

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C3=NC4=CC=CC=C4C(=C3)NCCC(O)O

InChI

InChI=1S/C21H23N3O2/c25-21(26)9-11-22-19-13-20(23-18-8-4-3-7-17(18)19)24-12-10-15-5-1-2-6-16(15)14-24/h1-8,13,21,25-26H,9-12,14H2,(H,22,23)