Chem
J-GLOBAL ID：200907094339826883
Nikkaji number：J485.256G
(2R)-5,7-Dichloro-1,2,3,4-tetrahydro-4α-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]quinoline-2β-carboxylic acid
(2R)-5,7-ジクロロ-1,2,3,4-テトラヒドロ-4α-[(3-メチル-1,2,4-オキサジアゾール-5-イル)メチル]キノリン-2β-カルボン酸
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Molecular formula： C14H13Cl2N3O3
Molecular formula furigana： C14-H13-CL2-N3-O3
Molecular weight： 342.180
InChI：
InChI=1S/C14H13Cl2N3O3/c1-6-17-12(22-19-6)3-7-2-11(14(20)21)18-10-5-8(15)4-9(16)13(7)10/h4-5,7,11,18H,2-3H2,1H3,(H,20,21)/t7-,11-/m1/s1
InChI key：
BJFWVHQEANTRDS-RDDDGLTNSA-N
SMILES：
Cc1noc(C[C@H]2C[C@@H](Nc3cc(Cl)cc(Cl)c23)C(=O)O)n1
Systematic name (3)：
- (2R)-5,7-ジクロロ-1,2,3,4-テトラヒドロ-4α-[(3-メチル-1,2,4-オキサジアゾール-5-イル)メチル]キノリン-2β-カルボン酸
- (2R,4R)-5,7-ジクロロ-4-[(3-メチル-1,2,4-オキサジアゾール-5-イル)メチル]-1,2,3,4-テトラヒドロキノリン-2-カルボン酸
- (2R,4R)-5,7-dichloro-4-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-1,2,3,4-tetrahydroquinoline-2-carboxylic acid
- (2R)-5,7-Dichloro-1,2,3,4-tetrahydro-4α-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]quinoline-2β-carboxylic acid
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