Vitas-M small molecule compound
diethyl (6Z)-2-(1,3-benzodioxol-5-yl)-4-hydroxy-4-methyl-6-[2-(4-nitrophenyl)hydrazinylidene]cyclohexane-1,3-dicarboxylate
Catalog ID
STK373587
SMILES CCOC(=O)C1/C(=N\Nc2ccc(cc2)[N+](=O)[O-])/CC(C(C1c1ccc2c(c1)OCO2)C(=O)OCC)(C)O
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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 C26H29N3O9 MW 527.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29N3O9/c1-4-35-24(30)22-18(28-27-16-7-9-17(10-8-16)29(33)34)13-26(3,32)23(25(31)36-5-2)21(22)15-6-11-19-20(12-15)38-14-37-19/h6-12,21-23,27,32H,4-5,13-14H2,1-3H3/b28-18-InChIKey
KIQGYOAASREFHV-VEILYXNESA-NSynonyms
CCOC(=O)C1C(=NNc2ccc(cc2)(N+)(=O)(O))CC(C(C1c1ccc2c(c1)OCO2)C(=O)OCC)(C)O
CCOC(=O)C1C(C(C(CC1=NNC2=CC=C(C=C2)(N+)(=O)(O))(C)O)C(=O)OCC)C3=CC4=C(C=C3)OCO4
DIETHYL(6Z)2(13BENZODIOXOL5YL)4HYDROXY4METHYL6((4NITROPHENYL)HYDRAZINYLIDENE)CYCLOHEXANE13DICARBOXYLATE
diethyl(6Z)2(13benzodioxol5yl)4hydroxy4methyl6(2(4nitrophenyl)hydrazinylidene)cyclohexane13dicarboxylate
ETHYL6(2HBENZO(34D)13DIOXOLAN5YL)5(ETHOXYCARBONYL)2HYDROXY2METHYL4(((4NITROPHENYL)AMINO)AZAMETHYLENE)CYCLOHEXANECARBOXYLATE
InChI=1SC26H29N3O9c143524(30)2218(2827167917(10816)29(33)34)1326(332)23(25(31)3652)21(22)156111920(1215)38143719h61221232732H451314H213H3b2818
MFCD00785458
ZINC000004108625
ZINC000138972129
Check stock
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Check stock on Vitas-MAvailable files
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