Vitas-M small molecule compound
2-chlorobenzyl 3-(1,3-dioxooctahydro-4,6-ethenocyclopropa[f]isoindol-2(1H)-yl)propanoate
Catalog ID
STK290719
SMILES O=C(OCc1ccccc1Cl)CCN1C(=O)C2C(C1=O)C1C=CC2C2C1C2
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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 C21H20ClNO4 MW 385.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20ClNO4/c22-16-4-2-1-3-11(16)10-27-17(24)7-8-23-20(25)18-12-5-6-13(15-9-14(12)15)19(18)21(23)26/h1-6,12-15,18-19H,7-10H2InChIKey
XBUIVWSKYHUACM-UHFFFAOYSA-NSynonyms
2chlorobenzyl3(13dioxooctahydro46ethenocyclopropa(f)isoindol2(1H)yl)propanoate
C1C2C1C3C=CC2C4C3C(=O)N(C4=O)CCC(=O)OCC5=CC=CC=C5Cl
InChI=1SC21H20ClNO4c2216421311(16)102717(24)782320(25)18125613(15914(12)15)19(18)21(23)26h1612151819H710H2
MFCD08097494
ZINC000239432996
ZINC000239432999
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