Chem
J-GLOBAL ID:200907046382130820
Nikkaji number:J1.235.995K
(1R,αR)-α-(4-Bromo-1,3-benzodioxole-5-yl)-6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinoline-1-methanol
(1R,αR)-α-(4-ブロモ-1,3-ベンゾジオキソール-5-イル)-6,7-ジメトキシ-2-メチル-1,2,3,4-テトラヒドロイソキノリン-1-メタノール
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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:
C20 H22 BrNO5
Molecular formula furigana:
C20-H22-BR-N-O5
Molecular weight:
436.302
InChI:
InChI=1S/C20H22BrNO5/c1-22-7-6-11-8-15(24-2)16(25-3)9-13(11)18(22)19(23)12-4-5-14-20(17(12)21)27-10-26-14/h4-5,8-9,18-19,23H,6-7,10H2,1-3H3/t18-,19-/m1/s1
InChI key:
YMCURQMVFGQKSO-RTBURBONSA-N
SMILES:
COc1cc2CCN(C)[C@@H]([C@H](O)c3ccc4OCOc4c3Br)c2cc1OC
Systematic name (3):
(1R,αR)-α-(4-ブロモ-1,3-ベンゾジオキソール-5-イル)-6,7-ジメトキシ-2-メチル-1,2,3,4-テトラヒドロイソキノリン-1-メタノール
(R)-(4-ブロモ-2H-1,3-ベンゾジオキソール-5-イル)[(1R)-6,7-ジメトキシ-2-メチル-1,2,3,4-テトラヒドロイソキノリン-1-イル]メタノール
(R)-(4-bromo-2H-1,3-benzodioxol-5-yl)[(1R)-6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-1-yl]methanol
Other name (1):
(1R,αR)-α-(4-Bromo-1,3-benzodioxole-5-yl)-6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinoline-1-methanol
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