Vitas-M small molecule compound
3,4-dimethylphenyl 4-(4-nitrophenoxy)benzoate
Catalog ID
STK247193
SMILES O=C(c1ccc(cc1)Oc1ccc(cc1)[N+](=O)[O-])Oc1ccc(c(c1)C)C
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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 C21H17NO5 MW 363.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17NO5/c1-14-3-8-20(13-15(14)2)27-21(23)16-4-9-18(10-5-16)26-19-11-6-17(7-12-19)22(24)25/h3-13H,1-2H3InChIKey
AIFDUKAOZPFNSK-UHFFFAOYSA-NSynonyms
5253-24-7(34DIMETHYLPHENYL)4(4NITROPHENOXY)BENZOATE
34DIMETHYLPHENYL4(4NITROPHENOXY)BENZOATE
4(4NITROPHENOXY)BENZOICACID34DIMETHYLPHENYLESTER
5253247
CC1=C(C=C(C=C1)OC(=O)C2=CC=C(C=C2)OC3=CC=C(C=C3)(N+)(=O)(O))C
HYDRAZINECARBOXIMIDAMIDE2(1METHYL3PHENYL2PROPEN1YLIDENE)HYDROCHLORIDE(11)
InChI=1SC21H17NO5c1143820(1315(14)2)2721(23)164918(10516)261911617(71219)22(24)25h313H12H3
MFCD00355801
O=C(c1ccc(cc1)Oc1ccc(cc1)(N+)(=O)(O))Oc1ccc(c(c1)C)C
ZINC000000793743
ZINC00793743
ZINC793743
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