Chem
J-GLOBAL ID:200907000151802133
Nikkaji number:J1.377.590G
1-Benzyl-2β-[(E)-2-cyanoethenyl]pyrrolidine-3α-carboxylic acid methyl ester
1-ベンジル-2β-[(E)-2-シアノエテニル]ピロリジン-3α-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 H18 N2 O2
Molecular formula furigana:
C16-H18-N2-O2
Molecular weight:
270.332
InChI:
InChI=1S/C16H18N2O2/c1-20-16(19)14-9-11-18(15(14)8-5-10-17)12-13-6-3-2-4-7-13/h2-8,14-15H,9,11-12H2,1H3/b8-5+/t14-,15+/m1/s1
InChI key:
BRNKFCBOQGJHPG-ZRJDUIELSA-N
SMILES:
COC(=O)[C@@H]1CCN(Cc2ccccc2)[C@H]1/C=C/C#N
Systematic name (3):
1-ベンジル-2β-[(E)-2-シアノエテニル]ピロリジン-3α-カルボン酸メチル
メチル (2S,3R)-1-ベンジル-2-[(1E)-2-シアノエタ-1-エン-1-イル]ピロリジン-3-カルボキシラート
methyl (2S,3R)-1-benzyl-2-[(1E)-2-cyanoeth-1-en-1-yl]pyrrolidine-3-carboxylate
Other name (1):
1-Benzyl-2β-[(E)-2-cyanoethenyl]pyrrolidine-3α-carboxylic acid methyl ester
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