Chem
J-GLOBAL ID:200907052828383078
Nikkaji number:J412.737D
1,4-Dihydro-2,6-dimethyl-4-(4-chloro-3-nitrophenyl)pyridine-3,5-dicarboxylic acid dimethyl ester
1,4-ジヒドロ-2,6-ジメチル-4-(4-クロロ-3-ニトロフェニル)ピリジン-3,5-ジカルボン酸ジメチル
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Substance type:
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
Molecular formula:
C17 H17 ClN[N+]O5 [O-]
Molecular formula furigana:
C17-H17-CL-N2-O6
Molecular weight:
380.780
InChI:
InChI=1S/C17H17ClN2O6/c1-8-13(16(21)25-3)15(14(9(2)19-8)17(22)26-4)10-5-6-11(18)12(7-10)20(23)24/h5-7,15,19H,1-4H3
InChI key:
ABJXFSWUVONHAT-UHFFFAOYSA-N
SMILES:
COC(=O)C1=C(C)NC(=C(C1c1ccc(Cl)c(c1)[N+](=O)[O-])C(=O)OC)C
Systematic name (3):
1,4-ジヒドロ-2,6-ジメチル-4-(4-クロロ-3-ニトロフェニル)ピリジン-3,5-ジカルボン酸ジメチル
3,5-ジメチル 4-(4-クロロ-3-ニトロフェニル)-2,6-ジメチル-1,4-ジヒドロピリジン-3,5-ジカルボキシラート
3,5-dimethyl 4-(4-chloro-3-nitrophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
Other name (1):
1,4-Dihydro-2,6-dimethyl-4-(4-chloro-3-nitrophenyl)pyridine-3,5-dicarboxylic acid dimethyl ester
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