(1S,3R)-1-(2-chloranyl-7-methyl-quinolin-3-yl)butane-1,3-diol

Systemtic Name: (1S,3R)-1-(2-chloranyl-7-methyl-quinolin-3-yl)butane-1,3-diol Openeye Name: (1S,3R)-1-(2-chloro-7-methyl-3-quinolyl)butane-1,3-diol CAS Name: (1S,3R)-1-(2-chloro-7-methyl-3-quinolinyl)butane-1,3-diol IUPAC Name: (1S,3R)-1-(2-chloro-7-methylquinolin-3-yl)butane-1,3-diol Traditional Name: (1S,3R)-1-(2-chloro-7-methyl-3-quinolyl)butane-1,3-diol Formula: C14H16ClNO2 MolecularWeight: 265.73534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NC(=C(C=C2C=C1)C(CC(C)O)O)Cl

Isomeric SMILES

CC1=CC2=NC(=C(C=C2C=C1)[C@H](C[C@@H](C)O)O)Cl

InChI

InChI=1S/C14H16ClNO2/c1-8-3-4-10-7-11(13(18)6-9(2)17)14(15)16-12(10)5-8/h3-5,7,9,13,17-18H,6H2,1-2H3/t9-,13+/m1/s1