Vitas-M small molecule compound
5-(3,4-difluorophenyl)-9-nitro-2-phenyl-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
Catalog ID
STK558205
SMILES Fc1cc(ccc1F)C1Oc2ccc(cc2C2N1N=C(C2)c1ccccc1)[N+](=O)[O-]
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C22H15F2N3O3 MW 407.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H15F2N3O3/c23-17-8-6-14(10-18(17)24)22-26-20(12-19(25-26)13-4-2-1-3-5-13)16-11-15(27(28)29)7-9-21(16)30-22/h1-11,20,22H,12H2InChIKey
CVPXFFKFKSORAW-UHFFFAOYSA-NSynonyms
585561-93-95(34difluorophenyl)9nitro2phenyl110bdihydropyrazolo(15c)(13)benzoxazine
5(34difluorophenyl)9nitro2phenyl510bdihydro1Hbenzo(e)pyrazolo(15c)(13)oxazine
5(34DIFLUOROPHENYL)9NITRO2PHENYL510BDIHYDRO1HPYRAZOLO(15C)(13)BENZOXAZINE
585561939
C1C2C3=C(C=CC(=C3)(N+)(=O)(O))OC(N2N=C1C4=CC=CC=C4)C5=CC(=C(C=C5)F)F
Fc1cc(ccc1F)C1Oc2ccc(cc2C2N1N=C(C2)c1ccccc1)(N+)(=O)(O)
InChI=1SC22H15F2N3O3c23178614(1018(17)24)222620(1219(2526)134213513)161115(27(28)29)7921(16)3022h1112022H12H2
MFCD04030721
ZINC000005111468
ZINC000013757380
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