Chem
J-GLOBAL ID:200907001348797936
Nikkaji number:J2.153.047F
2-(Nitro(13 C)methylene)-5-(2-fluorophenyl)-7-chloro-2,3-dihydro-1H-1,4-benzodiazepine
2-(ニトロ(13 C)メチレン)-5-(2-フルオロフェニル)-7-クロロ-2,3-ジヒドロ-1H-1,4-ベンゾジアゼピン
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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 [13 C]H11 ClFN2 [N+]O[O-]
Molecular formula furigana:
C16-H11-CL-F-N3-O2
Molecular weight:
332.720
InChI:
InChI=1S/C16H11ClFN3O2/c17-10-5-6-15-13(7-10)16(12-3-1-2-4-14(12)18)19-8-11(20-15)9-21(22)23/h1-7,9,20H,8H2/i9+1
InChI key:
URZUOAKBDKORRD-QBZHADDCSA-N
SMILES:
[O-][N+](=O)[13CH]=C1CN=C(c2ccccc2F)c2cc(Cl)ccc2N1
Systematic name (3):
2-(ニトロ(13 C)メチレン)-5-(2-フルオロフェニル)-7-クロロ-2,3-ジヒドロ-1H-1,4-ベンゾジアゼピン
7-クロロ-5-(2-フルオロフェニル)-2-[ニトロ(13 C)メチリデン]-2,3-ジヒドロ-1H-1,4-ベンゾジアゼピン
7-chloro-5-(2-fluorophenyl)-2-[nitro(13 C)methylidene]-2,3-dihydro-1H-1,4-benzodiazepine
Other name (1):
2-(Nitro(13 C)methylene)-5-(2-fluorophenyl)-7-chloro-2,3-dihydro-1H-1,4-benzodiazepine
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