Chem
J-GLOBAL ID:200907009556099496
Nikkaji number:J377.743J
1-(4-Trifluoromethylbenzyl)-1,2,3,4-tetrahydro-6-bromo-2,4-dioxoquinazoline-3-acetic acid
1-(4-トリフルオロメチルベンジル)-1,2,3,4-テトラヒドロ-6-ブロモ-2,4-ジオキソキナゾリン-3-酢酸
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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:
C18 H12 BrF3 N2 O4
Molecular formula furigana:
C18-H12-BR-F3-N2-O4
Molecular weight:
457.203
InChI:
InChI=1S/C18H12BrF3N2O4/c19-12-5-6-14-13(7-12)16(27)24(9-15(25)26)17(28)23(14)8-10-1-3-11(4-2-10)18(20,21)22/h1-7H,8-9H2,(H,25,26)
InChI key:
RMFLCNMKFHWWCJ-UHFFFAOYSA-N
SMILES:
OC(=O)Cn1c(=O)n(Cc2ccc(cc2)C(F)(F)F)c2ccc(Br)cc2c1=O
Systematic name (3):
1-(4-トリフルオロメチルベンジル)-1,2,3,4-テトラヒドロ-6-ブロモ-2,4-ジオキソキナゾリン-3-酢酸
2-(6-ブロモ-2,4-ジオキソ-1-{[4-(トリフルオロメチル)フェニル]メチル}-1,2,3,4-テトラヒドロキナゾリン-3-イル)酢酸
2-(6-bromo-2,4-dioxo-1-{[4-(trifluoromethyl)phenyl]methyl}-1,2,3,4-tetrahydroquinazolin-3-yl)acetic acid
Other name (1):
1-(4-Trifluoromethylbenzyl)-1,2,3,4-tetrahydro-6-bromo-2,4-dioxoquinazoline-3-acetic acid
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