Vitas-M small molecule compound
2-[4-(2-chloro-6-nitrophenoxy)phenyl]-2-oxoethyl 5-methyl-3-phenyl-1,2-oxazole-4-carboxylate
Catalog ID
STK535305
SMILES O=C(c1ccc(cc1)Oc1c(Cl)cccc1[N+](=O)[O-])COC(=O)c1c(C)onc1c1ccccc1
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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 C25H17ClN2O7 MW 492.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H17ClN2O7/c1-15-22(23(27-35-15)17-6-3-2-4-7-17)25(30)33-14-21(29)16-10-12-18(13-11-16)34-24-19(26)8-5-9-20(24)28(31)32/h2-13H,14H2,1H3InChIKey
LRIMVJNICPELMY-UHFFFAOYSA-NSynonyms
(2(4(2CHLORO6NITROPHENOXY)PHENYL)2OXOETHYL)5METHYL3PHENYL12OXAZOLE4CARBOXYLATE
2(4(2chloro6nitrophenoxy)phenyl)2oxoethyl5methyl3phenyl12oxazole4carboxylate
2(4(2chloro6nitrophenoxy)phenyl)2oxoethyl5methyl3phenylisoxazole4carboxylate
CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)OCC(=O)C3=CC=C(C=C3)OC4=C(C=CC=C4Cl)(N+)(=O)(O)
InChI=1SC25H17ClN2O7c11522(23(273515)176324717)25(30)331421(29)16101218(131116)342419(26)85920(24)28(31)32h213H14H21H3
MFCD02041075
O=C(c1ccc(cc1)Oc1c(Cl)cccc1(N+)(=O)(O))COC(=O)c1c(C)onc1c1ccccc1
ZINC000009065554
ZINC09065554
ZINC9065554
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