Vitas-M small molecule compound
ethyl 2-(3-chlorophenyl)-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxylate
Catalog ID
STK384098
SMILES CCOC(=O)C1C2C=CC3(C1C(=O)N(C3)c1cccc(c1)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 C17H16ClNO4 MW 333.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16ClNO4/c1-2-22-16(21)13-12-6-7-17(23-12)9-19(15(20)14(13)17)11-5-3-4-10(18)8-11/h3-8,12-14H,2,9H2,1H3InChIKey
RIQQBAOFMYKBQJ-UHFFFAOYSA-NSynonyms
(3aS6R7aR)ethyl2(3chlorophenyl)1oxo123677ahexahydro3a6epoxyisoindole7carboxylate
CCOC(=O)C1(C@H)2C=C(C@@)3((C@@H)1C(=O)N(C3)c1cccc(c1)Cl)O2
CCOC(=O)C1C2C=CC3(C1C(=O)N(C3)C4=CC(=CC=C4)Cl)O2
ethyl2(3chlorophenyl)1oxo123677ahexahydro3a6epoxyisoindole7carboxylate
InChI=1SC17H16ClNO4c122216(21)13126717(2312)919(15(20)14(13)17)1153410(18)811h381214H29H21H3
MFCD03849250
ZINC000100885635
ZINC000239402959
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