Chem
J-GLOBAL ID:200907037880459288
Nikkaji number:J424.763I
(1β,5β,8-anti)-8-Methyl-3β-[4-nitrophenyl]-8-azabicyclo[3.2.1]octane-2β-carboxylic acid methyl ester
(1β,5β,8-anti)-8-メチル-3β-[4-ニトロフェニル]-8-アザビシクロ[3.2.1]オクタン-2β-カルボン酸メチル
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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:
C16 H20 N[N+]O3 [O-]
Molecular formula furigana:
C16-H20-N2-O4
Molecular weight:
304.346
InChI:
InChI=1S/C16H20N2O4/c1-17-12-7-8-14(17)15(16(19)22-2)13(9-12)10-3-5-11(6-4-10)18(20)21/h3-6,12-15H,7-9H2,1-2H3/t12-,13+,14+,15-/m0/s1
InChI key:
JWBRJGZNZCKAEB-YJNKXOJESA-N
SMILES:
COC(=O)[C@@H]1[C@H]2CC[C@@H](C[C@@H]1c1ccc(cc1)[N+](=O)[O-])N2C
Systematic name (1):
(1β,5β,8-anti)-8-メチル-3β-[4-ニトロフェニル]-8-アザビシクロ[3.2.1]オクタン-2β-カルボン酸メチル
Other name (1):
(1β,5β,8-anti)-8-Methyl-3β-[4-nitrophenyl]-8-azabicyclo[3.2.1]octane-2β-carboxylic acid methyl ester
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