Vitas-M small molecule compound
3-(4-nitrophenyl)-6-phenyl-4a,7a,8,8a-tetrahydro-3aH-4,8-methano[1,2]oxazolo[4,5-f]isoindole-5,7(4H,6H)-dione
Catalog ID
STK782949
SMILES O=C1N(c2ccccc2)C(=O)C2C1C1CC2C2C1C(=NO2)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 C22H17N3O5 MW 403.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17N3O5/c26-21-16-14-10-15(17(16)22(27)24(21)12-4-2-1-3-5-12)20-18(14)19(23-30-20)11-6-8-13(9-7-11)25(28)29/h1-9,14-18,20H,10H2InChIKey
LOGYSZUFTVYLIL-UHFFFAOYSA-NSynonyms
(3aS4S4aR7aS8S8aS)3(4nitrophenyl)6phenyl44a88atetrahydro3aH48methanoisoxazolo(45f)isoindole57(6H7aH)dione
3(4NITROPHENYL)6PHENYL4A7A88ATETRAHYDRO3AH48METHANO(12)OXAZOLO(45F)ISOINDOLE57(4H6H)DIONE
C1C2C3C(C1C4C2C(=NO4)C5=CC=C(C=C5)(N+)(=O)(O))C(=O)N(C3=O)C6=CC=CC=C6
InChI=1SC22H17N3O5c262116141015(17(16)22(27)24(21)124213512)2018(14)19(233020)116813(9711)25(28)29h19141820H10H2
MFCD06617256
O=C1N(c2ccccc2)C(=O)(C@@H)2(C@H)1(C@H)1C(C@@H)2(C@H)2(C@@H)1C(=NO2)c1ccc(cc1)(N+)(=O)(O)
O=C1N(c2ccccc2)C(=O)C2C1C1CC2C2C1C(=NO2)c1ccc(cc1)(N+)(=O)(O)
ZINC000247320500
ZINC000247320540
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.