Vitas-M small molecule compound
benzyl 2-(3-chlorophenyl)-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxylate
Catalog ID
STK384104
SMILES Clc1cccc(c1)N1CC23C(C1=O)C(C(O3)C=C2)C(=O)OCc1ccccc1
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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 C22H18ClNO4 MW 395.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18ClNO4/c23-15-7-4-8-16(11-15)24-13-22-10-9-17(28-22)18(19(22)20(24)25)21(26)27-12-14-5-2-1-3-6-14/h1-11,17-19H,12-13H2InChIKey
WQZGTCCOWNMKLM-UHFFFAOYSA-NSynonyms
(3aS6R7aR)benzyl2(3chlorophenyl)1oxo123677ahexahydro3a6epoxyisoindole7carboxylate
benzyl2(3chlorophenyl)1oxo123677ahexahydro3a6epoxyisoindole7carboxylate
C1C23C=CC(O2)C(C3C(=O)N1C4=CC(=CC=C4)Cl)C(=O)OCC5=CC=CC=C5
Clc1cccc(c1)N1C(C@@)23(C@H)(C1=O)C((C@H)(O3)C=C2)C(=O)OCc1ccccc1
InChI=1SC22H18ClNO4c231574816(1115)24132210917(2822)18(19(22)20(24)25)21(26)2712145213614h1111719H1213H2
MFCD04041442
ZINC000226888198
ZINC000239235770
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