Chem
J-GLOBAL ID:200907076982595165
Nikkaji number:J2.263.938B
1-[(R)-α-Methyl-4-methoxybenzyl]-2α,5β-diethynylpyrrolidine
1-[(R)-α-メチル-4-メトキシベンジル]-2α,5β-ジエチニルピロリジン
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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 H19 NO
Molecular formula furigana:
C17-H19-N-O
Molecular weight:
253.345
InChI:
InChI=1S/C17H19NO/c1-5-15-9-10-16(6-2)18(15)13(3)14-7-11-17(19-4)12-8-14/h1-2,7-8,11-13,15-16H,9-10H2,3-4H3/t13-,15-,16-/m1/s1
InChI key:
CEVWNECCTULDHP-FVQBIDKESA-N
SMILES:
COc1ccc(cc1)[C@@H](C)N1[C@@H](CC[C@H]1C#C)C#C
Systematic name (3):
1-[(R)-α-メチル-4-メトキシベンジル]-2α,5β-ジエチニルピロリジン
(2S,5S)-2,5-ジエチニル-1-[(1R)-1-(4-メトキシフェニル)エチル]ピロリジン
(2S,5S)-2,5-diethynyl-1-[(1R)-1-(4-methoxyphenyl)ethyl]pyrrolidine
Other name (1):
1-[(R)-α-Methyl-4-methoxybenzyl]-2α,5β-diethynylpyrrolidine
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