Vitas-M small molecule compound
4-[3-acetyl-2-methyl-5-(3-nitrophenyl)-2,3-dihydro-1,3,4-oxadiazol-2-yl]phenyl acetate
Catalog ID
STK783986
SMILES CC(=O)Oc1ccc(cc1)C1(C)OC(=NN1C(=O)C)c1cccc(c1)[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 C19H17N3O6 MW 383.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17N3O6/c1-12(23)21-19(3,15-7-9-17(10-8-15)27-13(2)24)28-18(20-21)14-5-4-6-16(11-14)22(25)26/h4-11H,1-3H3InChIKey
IKWOCCNFHNGBJY-UHFFFAOYSA-NSynonyms
(4(3ACETYL2METHYL5(3NITROPHENYL)134OXADIAZOL2YL)PHENYL)ACETATE
4(3acetyl2methyl5(3nitrophenyl)23dihydro134oxadiazol2yl)phenylacetate
CC(=O)N1C(OC(=N1)C2=CC(=CC=C2)(N+)(=O)(O))(C)C3=CC=C(C=C3)OC(=O)C
CC(=O)Oc1ccc(cc1)C1(C)OC(=NN1C(=O)C)c1cccc(c1)(N+)(=O)(O)
InChI=1SC19H17N3O6c112(23)2119(3157917(10815)2713(2)24)2818(2021)1454616(1114)22(25)26h411H13H3
MFCD06619299
ZINC000004753601
ZINC000004753603
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