Chem
J-GLOBAL ID:200907052533628184
Nikkaji number:J2.643.924H
(2R)-1-[(S)-α-Methylbenzyl]-2-[2-(1,3-benzodioxole-5-yl)ethyl]-1,2,3,4-tetrahydroquinoline
(2R)-1-[(S)-α-メチルベンジル]-2-[2-(1,3-ベンゾジオキソール-5-イル)エチル]-1,2,3,4-テトラヒドロキノリン
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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:
C26 H27 NO2
Molecular formula furigana:
C26-H27-N-O2
Molecular weight:
385.507
InChI:
InChI=1S/C26H27NO2/c1-19(21-7-3-2-4-8-21)27-23(15-13-22-9-5-6-10-24(22)27)14-11-20-12-16-25-26(17-20)29-18-28-25/h2-10,12,16-17,19,23H,11,13-15,18H2,1H3/t19-,23+/m0/s1
InChI key:
UMSPFFTVQKOXPO-WMZHIEFXSA-N
SMILES:
C[C@H](N1[C@H](CCc2ccc3OCOc3c2)CCc2ccccc12)c1ccccc1
Systematic name (3):
(2R)-1-[(S)-α-メチルベンジル]-2-[2-(1,3-ベンゾジオキソール-5-イル)エチル]-1,2,3,4-テトラヒドロキノリン
(2R)-2-[2-(2H-1,3-ベンゾジオキソール-5-イル)エチル]-1-[(1S)-1-フェニルエチル]-1,2,3,4-テトラヒドロキノリン
(2R)-2-[2-(2H-1,3-benzodioxol-5-yl)ethyl]-1-[(1S)-1-phenylethyl]-1,2,3,4-tetrahydroquinoline
Other name (1):
(2R)-1-[(S)-α-Methylbenzyl]-2-[2-(1,3-benzodioxole-5-yl)ethyl]-1,2,3,4-tetrahydroquinoline
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