Vitas-M small molecule compound
7-[3-(4-nitrophenyl)-1,2,4-oxadiazol-5-yl]hexahydro-2H-3,5-methanocyclopenta[b]furan-2-one
Catalog ID
STK784713
SMILES O=C1OC2C3C1C(C(C2)C3)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 C16H13N3O5 MW 327.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13N3O5/c20-16-13-10-5-8(6-11(10)23-16)12(13)15-17-14(18-24-15)7-1-3-9(4-2-7)19(21)22/h1-4,8,10-13H,5-6H2InChIKey
NNQNAIAOFWBWKX-UHFFFAOYSA-NSynonyms
7(3(4nitrophenyl)124oxadiazol5yl)hexahydro2H35methanocyclopenta(b)furan2one
C1C2CC3C1C(C2C4=NC(=NO4)C5=CC=C(C=C5)(N+)(=O)(O))C(=O)O3
InChI=1SC16H13N3O5c2016131058(611(10)2316)12(13)151714(182415)7139(427)19(21)22h1481013H56H2
MFCD07757648
O=C1OC2C3C1C(C(C2)C3)c1onc(n1)c1ccc(cc1)(N+)(=O)(O)
ZINC000103027290
ZINC000247326191
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