Vitas-M small molecule compound
3,3-dimethyl-2-oxobutyl 2-(3-chloro-4-methylphenyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylate
Catalog ID
STK258048
SMILES O=C(C(C)(C)C)COC(=O)c1ccc2c(c1)C(=O)N(C2=O)c1ccc(c(c1)Cl)C
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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 C22H20ClNO5 MW 413.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20ClNO5/c1-12-5-7-14(10-17(12)23)24-19(26)15-8-6-13(9-16(15)20(24)27)21(28)29-11-18(25)22(2,3)4/h5-10H,11H2,1-4H3InChIKey
MAJLCBPMNWMYDP-UHFFFAOYSA-NSynonyms
664974-84-9(33DIMETHYL2OXOBUTYL)2(3CHLORO4METHYLPHENYL)13DIOXOISOINDOLE5CARBOXYLATE
33dimethyl2oxobutyl2(3chloro4methylphenyl)13dioxo23dihydro1Hisoindole5carboxylate
33DIMETHYL2OXOBUTYL2(3CHLORO4METHYLPHENYL)13DIOXO5ISOINDOLINECARBOXYLATE
664974849
CC1=C(C=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)OCC(=O)C(C)(C)C)Cl
InChI=1SC22H20ClNO5c1125714(1017(12)23)2419(26)158613(916(15)20(24)27)21(28)291118(25)22(23)4h510H11H214H3
MFCD03274389
ZINC000000992801
ZINC00992801
ZINC992801
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