Vitas-M small molecule compound
pentyl 2-(2-bromophenyl)-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxylate
Catalog ID
STK384179
SMILES CCCCCOC(=O)C1C2C=CC3(C1C(=O)N(C3)c1ccccc1Br)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 C20H22BrNO4 MW 420.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22BrNO4/c1-2-3-6-11-25-19(24)16-15-9-10-20(26-15)12-22(18(23)17(16)20)14-8-5-4-7-13(14)21/h4-5,7-10,15-17H,2-3,6,11-12H2,1H3InChIKey
CKCXYQYBGQLBIQ-UHFFFAOYSA-NSynonyms
1009317-36-51009317365
CCCCCOC(=O)C1C2C=CC3(C1C(=O)N(C3)C4=CC=CC=C4Br)O2
InChI=1SC20H22BrNO4c1236112519(24)161591020(2615)1222(18(23)17(16)20)14854713(14)21h457101517H2361112H21H3
MFCD03849271
pentyl2(2bromophenyl)1oxo123677ahexahydro3a6epoxyisoindole7carboxylate
ZINC000226888712
ZINC000239030839
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