Vitas-M small molecule compound
4-[3-(4-nitrophenyl)-1,2,4-oxadiazol-5-yl]phenyl benzoate
Catalog ID
STK017801
SMILES O=C(c1ccccc1)Oc1ccc(cc1)c1onc(n1)c1ccc(cc1)[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 C21H13N3O5 MW 387.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H13N3O5/c25-21(16-4-2-1-3-5-16)28-18-12-8-15(9-13-18)20-22-19(23-29-20)14-6-10-17(11-7-14)24(26)27/h1-13HInChIKey
YTUBQHCMTANOGO-UHFFFAOYSA-NSynonyms
(4(3(4NITROPHENYL)124OXADIAZOL5YL)PHENYL)BENZOATE
4(3(4NITROPHENYL)124OXADIAZOL5YL)PHENYLBENZOATE
C1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C3=NC(=NO3)C4=CC=C(C=C4)(N+)(=O)(O)
InChI=1SC21H13N3O5c2521(164213516)281812815(91318)202219(232920)1461017(11714)24(26)27h113H
MFCD01933295
O=C(c1ccccc1)Oc1ccc(cc1)c1onc(n1)c1ccc(cc1)(N+)(=O)(O)
STK017801
ZINC000004576235
ZINC04576235
ZINC4576235
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