Vitas-M small molecule compound
5-(4-ethoxyphenyl)-9-nitro-2-[4-(prop-2-en-1-yloxy)phenyl]-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
Catalog ID
STK645450
SMILES C=CCOc1ccc(cc1)C1=NN2C(C1)c1cc(ccc1OC2c1ccc(cc1)OCC)[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 C27H25N3O5 MW 471.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25N3O5/c1-3-15-34-22-10-5-18(6-11-22)24-17-25-23-16-20(30(31)32)9-14-26(23)35-27(29(25)28-24)19-7-12-21(13-8-19)33-4-2/h3,5-14,16,25,27H,1,4,15,17H2,2H3InChIKey
DIXVVVHXYDJZIK-UHFFFAOYSA-NSynonyms
384369-94-22(4(allyloxy)phenyl)5(4ethoxyphenyl)9nitro510bdihydro1Hbenzo(e)pyrazolo(15c)(13)oxazine
384369942
5(4ethoxyphenyl)9nitro2(4(prop2en1yloxy)phenyl)110bdihydropyrazolo(15c)(13)benzoxazine
5(4ETHOXYPHENYL)9NITRO2(4PROP2ENOXYPHENYL)510BDIHYDRO1HPYRAZOLO(15C)(13)BENZOXAZINE
C=CCOc1ccc(cc1)C1=NN2C(C1)c1cc(ccc1OC2c1ccc(cc1)OCC)(N+)(=O)(O)
CCOC1=CC=C(C=C1)C2N3C(CC(=N3)C4=CC=C(C=C4)OCC=C)C5=C(O2)C=CC(=C5)(N+)(=O)(O)
InChI=1SC27H25N3O5c1315342210518(61122)241725231620(30(31)32)91426(23)3527(29(25)2824)1971221(13819)3342h3514162527H141517H22H3
MFCD03284821
ZINC000009216209
ZINC000013552042
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