Vitas-M small molecule compound

2-{[2-({[3-(ethoxycarbonyl)-2-methyl-1-benzofuran-5-yl]oxy}acetyl)hydrazinyl]carbonyl}cyclohexanecarboxylic acid

Catalog ID
STK888360
SMILES CCOC(=O)c1c(C)oc2c1cc(OCC(=O)NNC(=O)C1CCCCC1C(=O)O)cc2

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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 C22H26N2O8 MW 446.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N2O8/c1-3-30-22(29)19-12(2)32-17-9-8-13(10-16(17)19)31-11-18(25)23-24-20(26)14-6-4-5-7-15(14)21(27)28/h8-10,14-15H,3-7,11H2,1-2H3,(H,23,25)(H,24,26)(H,27,28)
InChIKey
ZGWQYLYCPCNWED-UHFFFAOYSA-N
Synonyms
610758-88-8
2(((2((3ETHOXYCARBONYL2METHYL1BENZOFURAN5YL)OXY)ACETYL)AMINO)CARBAMOYL)CYCLOHEXANE1CARBOXYLICACID
2((2(((3(ETHOXYCARBONYL)2METHYL1BENZOFURAN5YL)OXY)ACETYL)HYDRAZINO)CARBONYL)CYCLOHEXANECARBOXYLICACID
2((2(((3(ethoxycarbonyl)2methyl1benzofuran5yl)oxy)acetyl)hydrazinyl)carbonyl)cyclohexanecarboxylicacid
2(2(2((3(ethoxycarbonyl)2methylbenzofuran5yl)oxy)acetyl)hydrazinecarbonyl)cyclohexanecarboxylicacid
2(N(2(3(ETHOXYCARBONYL)2METHYLBENZO(B)FURAN5YLOXY)ACETYLAMINO)CARBAMOYL)CYCLOHEXANECARBOXYLICACID
610758888
CCOC(=O)C1=C(OC2=C1C=C(C=C2)OCC(=O)NNC(=O)C3CCCCC3C(=O)O)C
InChI=1SC22H26N2O8c133022(29)1912(2)32179813(1016(17)19)311118(25)232420(26)14645715(14)21(27)28h8101415H3711H212H3(H2325)(H2426)(H2728)
MFCD03668913
ZINC000009402777
ZINC000009402780

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.