Vitas-M small molecule compound
5-chloro-2-(2-methoxy-4-nitrophenyl)-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
Catalog ID
STK331455
SMILES COc1cc(ccc1N1C(=O)C2C(C1=O)CC(=CC2)Cl)[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 C15H13ClN2O5 MW 336.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H13ClN2O5/c1-23-13-7-9(18(21)22)3-5-12(13)17-14(19)10-4-2-8(16)6-11(10)15(17)20/h2-3,5,7,10-11H,4,6H2,1H3InChIKey
TVORATJUDITFHY-UHFFFAOYSA-NSynonyms
5chloro2(2methoxy4nitrophenyl)3a477atetrahydro1Hisoindole13(2H)dione
5chloro2(2methoxy4nitrophenyl)3a477atetrahydroisoindole13dione
COC1=C(C=CC(=C1)(N+)(=O)(O))N2C(=O)C3CC=C(CC3C2=O)Cl
COc1cc(ccc1N1C(=O)C2C(C1=O)CC(=CC2)Cl)(N+)(=O)(O)
InChI=1SC15H13ClN2O5c1231379(18(21)22)3512(13)1714(19)10428(16)611(10)15(17)20h23571011H46H21H3
MFCD03321261
ZINC000005879775
ZINC000102039932
Check stock
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Check stock on Vitas-MAvailable files
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