Chem
J-GLOBAL ID:200907062209349316
Nikkaji number:J2.457.061D
1-[[(18 O2 )Tosyl](16 O)oxy]-1-(3-nitrophenyl)ethane
1-[[(18 O2 )トシル](16 O)オキシ]-1-(3-ニトロフェニル)エタン
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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:
C15 H15 [N+]O[O-][16 O][18 O]2 S
Molecular formula furigana:
C15-H15-N-O5-S
Molecular weight:
325.340
InChI:
InChI=1S/C15H15NO5S/c1-11-6-8-15(9-7-11)22(19,20)21-12(2)13-4-3-5-14(10-13)16(17)18/h3-10,12H,1-2H3/i19+2,20+2,21+0
InChI key:
JXTQWVDJKIWWHJ-YFCMVATNSA-N
SMILES:
CC([16O]S(=[18O])(=[18O])c1ccc(C)cc1)c1cccc(c1)[N+](=O)[O-]
Systematic name (3):
1-[[(18 O2 )トシル](16 O)オキシ]-1-(3-ニトロフェニル)エタン
1-(3-ニトロフェニル)エチル 4-メチルベンゼン-1-(16 O1, 18 O2 )スルホナート
1-(3-nitrophenyl)ethyl 4-methylbenzene-1-(16 O1, 18 O2 )sulfonate
Other name (1):
1-[[(18 O2 )Tosyl](16 O)oxy]-1-(3-nitrophenyl)ethane
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