Chem
J-GLOBAL ID:201407019841914670
Nikkaji number:J3.309.614C
PBT-1
1-[(2-メトキシフェナントロ[2,3-d][1,3]ジオキソール-5-イル)メチル]ピペリジン-4-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:
C23 H25 NO4
Molecular formula furigana:
C23-H25-N-O4
Molecular weight:
379.456
InChI:
InChI=1S/C23H25NO4/c1-26-18-2-3-19-17(12-24-6-4-15(13-25)5-7-24)8-16-9-22-23(28-14-27-22)11-20(16)21(19)10-18/h2-3,8-11,15,25H,4-7,12-14H2,1H3
InChI key:
GFBRRLPJNPKOEJ-UHFFFAOYSA-N
SMILES:
COc1ccc2c(CN3CCC(CO)CC3)cc3cc4OCOc4cc3c2c1
Systematic name (3):
1-[(2-メトキシフェナントロ[2,3-d][1,3]ジオキソール-5-イル)メチル]ピペリジン-4-メタノール
[1-({2-メトキシ-9H-フェナントロ[2,3-d][1,3]ジオキソール-5-イル}メチル)ピペリジン-4-イル]メタノール
[1-({2-methoxy-9H-phenanthro[2,3-d][1,3]dioxol-5-yl}methyl)piperidin-4-yl]methanol
Other name (2):
1-[(2-Methoxyphenanthro[2,3-d][1,3]dioxole-5-yl)methyl]piperidine-4-methanol
PBT-1
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