羧酸塞来昔布
Celecoxib Carboxylic Acid
4-[1-[4-(氨基磺酰基)苯基]-3-(三氟甲基)-1H-吡唑-5-基]苯甲酸, Celecoxib metabolite M2, 4-[1-[4-(Aminosulfonyl)phenyl]-3-(trifluoromethyl)-1H-pyrazol-5-yl]benzoic Acid, Celecoxib Carboxylic Acid, Celebrex Carboxylic Acid, UNII-EQJ1364UKF, Celecoxib Impurity 2
CAS号: 170571-01-4
IUPAC名称: 4-[1-(4-sulfamoylphenyl)-3-(trifluoromethyl)pyrazol-5-yl]benzoic acid
分子式: C17H12F3N3O4S
分子量: 411.35500
InChI: InChI=1S/C17H12F3N3O4S/c18-17(19,20)15-9-14(10-1-3-11(4-2-10)16(24)25)23(22-15)12-5-7-13(8-6-12)28(21,26)27/h1-9H,(H,24,25)(H2,21,26,27)
InChIKey: WTHNOVFEXONZMI-UHFFFAOYSA-N
SMILES: -
EINECS: C1=CC(=CC=C1C2=CC(=NN2C3=CC=C(C=C3)S(=O)(=O)N)C(F)(F)F)C(=O)O
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