Chem
J-GLOBAL ID:200907088278485832
Nikkaji number:J2.381.141C
1-Methyl-2-[(3,5-2 H2 )phenyl]-5-[(2 H3 )methyl]1H-pyrazole-3(2H)-one
1-メチル-2-[(3,5-2 H2 )フェニル]-5-[(2 H3 )メチル]1H-ピラゾール-3(2H)-オン
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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:
C11 H7 [2 H]5 N2 O
Molecular formula furigana:
C11-H12-N2-O
Molecular weight:
193.261
InChI:
InChI=1S/C11H12N2O/c1-9-8-11(14)13(12(9)2)10-6-4-3-5-7-10/h3-8H,1-2H3/i1D3,4D,5D
InChI key:
VEQOALNAAJBPNY-CLHTXULSSA-N
SMILES:
c1([2H])cc([2H])cc(c1)n1n(C)c(cc1=O)C([2H])([2H])[2H]
Systematic name (3):
1-メチル-2-[(3,5-2 H2 )フェニル]-5-[(2 H3 )メチル]1H-ピラゾール-3(2H)-オン
5-(2 H3 )メチル-1-メチル-2-[(3,5-2 H2 )フェニル]-2,3-ジヒドロ-1H-ピラゾール-3-オン
5-(2 H3 )methyl-1-methyl-2-[(3,5-2 H2 )phenyl]-2,3-dihydro-1H-pyrazol-3-one
Other name (1):
1-Methyl-2-[(3,5-2 H2 )phenyl]-5-[(2 H3 )methyl]1H-pyrazole-3(2H)-one
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