Vitas-M small molecule compound
4-[1,3-dioxo-8-(propan-2-ylidene)-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl]phenyl acetate
Catalog ID
STK258082
SMILES CC(=O)Oc1ccc(cc1)N1C(=O)C2C(C1=O)C1C(=C(C)C)C2C=C1
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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 C20H19NO4 MW 337.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19NO4/c1-10(2)16-14-8-9-15(16)18-17(14)19(23)21(20(18)24)12-4-6-13(7-5-12)25-11(3)22/h4-9,14-15,17-18H,1-3H3InChIKey
GCXZUGUVRMHIBL-UHFFFAOYSA-NSynonyms
4(13dioxo8(propan2ylidene)133a477ahexahydro2H47methanoisoindol2yl)phenylacetate
CC(=C1C2C=CC1C3C2C(=O)N(C3=O)C4=CC=C(C=C4)OC(=O)C)C
InChI=1SC20H19NO4c110(2)16148915(16)1817(14)19(23)21(20(18)24)124613(7512)2511(3)22h4914151718H13H3
MFCD01802273
ZINC000100186944
ZINC000101360452
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