Chem
J-GLOBAL ID：200907063756167199   Nikkaji number：J553.153E

(S,S)-Furnidipine

(S,S)-フルニジピン
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： C21H24N[N+]O6[O-]
Molecular formula furigana： C21-H24-N2-O7
Molecular weight： 416.430
InChI： InChI=1S/C21H24N2O7/c1-12-17(20(24)28-3)19(15-8-4-5-9-16(15)23(26)27)18(13(2)22-12)21(25)30-11-14-7-6-10-29-14/h4-5,8-9,14,19,22H,6-7,10-11H2,1-3H3/t14-,19-/m0/s1
InChI key： GGVUNNUOJDGCBK-LIRRHRJNSA-N
SMILES： COC(=O)C1=C(C)NC(=C([C@H]1c1ccccc1[N+](=O)[O-])C(=O)OC[C@@H]1CCCO1)C
Systematic name  (3)：
  • (S)-1,4-ジヒドロ-2,6-ジメチル-4-(2-ニトロフェニル)-3,5-ピリジンジカルボン酸3-[(テトラヒドロフラン)-2α-イルメチル]5-メチル
  • 3-メチル 5-[(2S)-オキソラン-2-イル]メチル (4S)-2,6-ジメチル-4-(2-ニトロフェニル)-1,4-ジヒドロピリジン-3,5-ジカルボキシラート
  • 3-methyl 5-[(2S)-oxolan-2-yl]methyl (4S)-2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
Other name (3)：
  • (S)-1,4-Dihydro-2,6-dimethyl-4-(2-nitrophenyl)-3,5-pyridinedicarboxylic acid 3-[(tetrahydrofuran)-2α-ylmethyl]5-methyl ester
  • (S,S)-フルニジピン
  • (S,S)-Furnidipine
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