Vitas-M small molecule compound
2-(4-chloro-3-methylphenyl)-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxylic acid
Catalog ID
STK384665
SMILES OC(=O)C1C2C=CC3(C1C(=O)N(C3)c1ccc(c(c1)C)Cl)O2
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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 C16H14ClNO4 MW 319.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14ClNO4/c1-8-6-9(2-3-10(8)17)18-7-16-5-4-11(22-16)12(15(20)21)13(16)14(18)19/h2-6,11-13H,7H2,1H3,(H,20,21)InChIKey
HAQHXXYVHFLMIV-UHFFFAOYSA-NSynonyms
2(4chloro3methylphenyl)1oxo123677ahexahydro3a6epoxyisoindole7carboxylicacid
CC1=C(C=CC(=C1)N2CC34C=CC(O3)C(C4C2=O)C(=O)O)Cl
InChI=1SC16H14ClNO4c1869(2310(8)17)187165411(2216)12(15(20)21)13(16)14(18)19h261113H7H21H3(H2021)
MFCD05661637
ZINC000004556358
ZINC000102099823
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