Chem
J-GLOBAL ID:201707015254284483
Nikkaji number:J3.620.118E
5-BDBD
5-(3-ブロモフェニル)-1,3-ジヒドロ-2H-ベンゾフロ[3,2-e]-1,4-ジアゼピン-2-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:
C17 H11 BrN2 O2
Molecular formula furigana:
C17-H11-BR-N2-O2
Molecular weight:
355.191
InChI:
InChI=1S/C17H11BrN2O2/c18-11-5-3-4-10(8-11)15-17-16(20-14(21)9-19-15)12-6-1-2-7-13(12)22-17/h1-8H,9H2,(H,20,21)
InChI key:
NKYMVQPXXTZHSF-UHFFFAOYSA-N
SMILES:
Brc1cccc(c1)C1=NCC(=O)Nc2c1oc1ccccc21
Systematic name (3):
5-(3-ブロモフェニル)-1,3-ジヒドロ-2H-ベンゾフロ[3,2-e]-1,4-ジアゼピン-2-オン
10-(3-ブロモフェニル)-8-オキサ-11,14-ジアザトリシクロ[7.5.0.02,7 ]テトラデカ-1(9),2,4,6,10-ペンタエン-13-オン
10-(3-bromophenyl)-8-oxa-11,14-diazatricyclo[7.5.0.02,7 ]tetradeca-1(9),2,4,6,10-pentaen-13-one
Other name (2):
5-(3-Bromophenyl)-1,3-dihydro-2H-benzofuro[3,2-e]-1,4-diazepine-2-one
5-BDBD
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