(4S)-2-(4,8-dimethylquinolin-2-yl)-4-(2-hydroxyethyl)-5-methyl-4H-pyrazol-3-one

Systemtic Name: (4S)-2-(4,8-dimethylquinolin-2-yl)-4-(2-hydroxyethyl)-5-methyl-4H-pyrazol-3-one Openeye Name: (4S)-2-(4,8-dimethyl-2-quinolyl)-4-(2-hydroxyethyl)-5-methyl-4H-pyrazol-3-one CAS Name: (4S)-2-(4,8-dimethyl-2-quinolinyl)-4-(2-hydroxyethyl)-5-methyl-4H-pyrazol-3-one IUPAC Name: (4S)-2-(4,8-dimethylquinolin-2-yl)-4-(2-hydroxyethyl)-5-methyl-4H-pyrazol-3-one Traditional Name: (4S)-2-(4,8-dimethyl-2-quinolyl)-4-(2-hydroxyethyl)-5-methyl-2-pyrazolin-3-one Formula: C17H19N3O2 MolecularWeight: 297.35166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C(C=C2C)N3C(=O)C(C(=N3)C)CCO

Isomeric SMILES

CC1=CC=CC2=C1N=C(C=C2C)N3C(=O)[C@H](C(=N3)C)CCO

InChI

InChI=1S/C17H19N3O2/c1-10-5-4-6-13-11(2)9-15(18-16(10)13)20-17(22)14(7-8-21)12(3)19-20/h4-6,9,14,21H,7-8H2,1-3H3/t14-/m0/s1