Vitas-M small molecule compound
2-(3-chloro-4-methylphenyl)-3a,3b,4,5,6,7,8,9,9a,9b-decahydro-1H-dicyclopenta[e,g]isoindole-1,3(2H)-dione
Catalog ID
STK027193
SMILES O=C1N(c2ccc(c(c2)Cl)C)C(=O)C2C1C1CCCC1=C1C2CCC1
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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 C21H22ClNO2 MW 355.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22ClNO2/c1-11-8-9-12(10-17(11)22)23-20(24)18-15-6-2-4-13(15)14-5-3-7-16(14)19(18)21(23)25/h8-10,15-16,18-19H,2-7H2,1H3InChIKey
LXWFZMOMVNLPLZ-UHFFFAOYSA-NSynonyms
2(3chloro4methylphenyl)3a3b4567899a9bdecahydro1Hdicyclopenta(eg)isoindole13(2H)dione
2(3chloro4methylphenyl)3a3b4567899a9bdecahydroasindaceno(45c)pyrrole13dione
CC1=C(C=C(C=C1)N2C(=O)C3C4CCCC4=C5CCCC5C3C2=O)Cl
InChI=1SC21H22ClNO2c1118912(1017(11)22)2320(24)181562413(15)1453716(14)19(18)21(23)25h81015161819H27H21H3
MFCD01070578
O=C1N(c2ccc(c(c2)Cl)C)C(=O)C2C1C1CCCC1=C1C2CCC1
STK027193
ZINC000018285177
ZINC000239339277
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