Vitas-M small molecule compound
5-methyl-2-(propan-2-yl)cyclohexyl 2-(4-nitrophenyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylate
Catalog ID
STK267966
SMILES CC1CCC(C(C1)OC(=O)c1ccc2c(c1)C(=O)N(C2=O)c1ccc(cc1)[N+](=O)[O-])C(C)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 C25H26N2O6 MW 450.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N2O6/c1-14(2)19-10-4-15(3)12-22(19)33-25(30)16-5-11-20-21(13-16)24(29)26(23(20)28)17-6-8-18(9-7-17)27(31)32/h5-9,11,13-15,19,22H,4,10,12H2,1-3H3InChIKey
XVNLDAHYGUOZCH-UHFFFAOYSA-NSynonyms
(5METHYL2PROPAN2YLCYCLOHEXYL)2(4NITROPHENYL)13DIOXOISOINDOLE5CARBOXYLATE
2ISOPROPYL5METHYLCYCLOHEXYL2(4NITROPHENYL)13DIOXO5ISOINDOLINECARBOXYLATE
5METHYL2(METHYLETHYL)CYCLOHEXYL2(4NITROPHENYL)13DIOXOBENZO(C)AZOLIDINE5CARBOXYLATE
5methyl2(propan2yl)cyclohexyl2(4nitrophenyl)13dioxo23dihydro1Hisoindole5carboxylate
CC1CCC(C(C1)OC(=O)c1ccc2c(c1)C(=O)N(C2=O)c1ccc(cc1)(N+)(=O)(O))C(C)C
CC1CCC(C(C1)OC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)C4=CC=C(C=C4)(N+)(=O)(O))C(C)C
InChI=1SC25H26N2O6c114(2)1910415(3)1222(19)3325(30)165112021(1316)24(29)26(23(20)28)176818(9717)27(31)32h591113151922H41012H213H3
MFCD01080619
ZINC000004113416
ZINC000013576410
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.