Vitas-M small molecule compound
2-(4-chloro-3-nitrophenyl)tetrahydro-1H-4,7-ethanoisoindole-1,3,5,8(2H,4H)-tetrone
Catalog ID
STK544922
SMILES O=C1CC2C(=O)CC1C1C2C(=O)N(C1=O)c1ccc(c(c1)[N+](=O)[O-])Cl
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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 C16H11ClN2O6 MW 362.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H11ClN2O6/c17-9-2-1-6(3-10(9)19(24)25)18-15(22)13-7-4-11(20)8(5-12(7)21)14(13)16(18)23/h1-3,7-8,13-14H,4-5H2InChIKey
LGHKROZCWUTKDD-UHFFFAOYSA-NSynonyms
459154-81-5(3aR4R7R7aS)2(4chloro3nitrophenyl)tetrahydro1H47ethanoisoindole1358(2H6H)tetraone
2(4chloro3nitrophenyl)tetrahydro1H47ethanoisoindole1358(2H4H)tetrone
459154815
C1C2C3C(C(C1=O)CC2=O)C(=O)N(C3=O)C4=CC(=C(C=C4)Cl)(N+)(=O)(O)
InChI=1SC16H11ClN2O6c179216(310(9)19(24)25)1815(22)137411(20)8(512(7)21)14(13)16(18)23h13781314H45H2
MFCD03007650
O=C1CC2C(=O)CC1C1C2C(=O)N(C1=O)c1ccc(c(c1)(N+)(=O)(O))Cl
ZINC000100810660
ZINC000143678980
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