Vitas-M small molecule compound
4-chloro-2-(5-methyl-1,3-dioxooctahydro-2H-isoindol-2-yl)phenyl furan-2-carboxylate
Catalog ID
STK253779
SMILES CC1CCC2C(C1)C(=O)N(C2=O)c1cc(Cl)ccc1OC(=O)c1ccco1
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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 C20H18ClNO5 MW 387.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18ClNO5/c1-11-4-6-13-14(9-11)19(24)22(18(13)23)15-10-12(21)5-7-16(15)27-20(25)17-3-2-8-26-17/h2-3,5,7-8,10-11,13-14H,4,6,9H2,1H3InChIKey
BHABKFZVSPMSAA-UHFFFAOYSA-NSynonyms
(4chloro2(5methyl13dioxo3a45677ahexahydroisoindol2yl)phenyl)furan2carboxylate
4CHLORO2((3AR5R7AS)5METHYL13DIOXOOCTAHYDRO2HISOINDOL2YL)PHENYLFURAN2CARBOXYLATE
4chloro2(5methyl13dioxooctahydro2Hisoindol2yl)phenylfuran2carboxylate
CC1CCC2C(C1)C(=O)N(C2=O)C3=C(C=CC(=C3)Cl)OC(=O)C4=CC=CO4
InChI=1SC20H18ClNO5c111461314(911)19(24)22(18(13)23)151012(21)5716(15)2720(25)173282617h2357810111314H469H21H3
MFCD03355513
ZINC000004145955
ZINC000239275182
ZINC02830892
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