Vitas-M small molecule compound
3-({4-[(1Z)-2-cyano-3-(morpholin-4-yl)-3-oxoprop-1-en-1-yl]-2-methoxyphenoxy}methyl)benzoic acid
Catalog ID
STK380581
SMILES N#C/C(=C/c1ccc(c(c1)OC)OCc1cccc(c1)C(=O)O)/C(=O)N1CCOCC1
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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 C23H22N2O6 MW 422.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N2O6/c1-29-21-13-16(11-19(14-24)22(26)25-7-9-30-10-8-25)5-6-20(21)31-15-17-3-2-4-18(12-17)23(27)28/h2-6,11-13H,7-10,15H2,1H3,(H,27,28)/b19-11-InChIKey
FCJSBDMGJOHRBI-ODLFYWEKSA-NSynonyms
3((4((1Z)2cyano3(morpholin4yl)3oxoprop1en1yl)2methoxyphenoxy)methyl)benzoicacid
3((4((1Z)2CYANO3MORPHOLIN4YL3OXOPROP1ENYL)2METHOXYPHENOXY)METHYL)BENZOICACID
3((4((Z)2cyano3morpholin4yl3oxoprop1enyl)2methoxyphenoxy)methyl)benzoicacid
COC1=C(C=CC(=C1)C=C(C#N)C(=O)N2CCOCC2)OCC3=CC=CC(=C3)C(=O)O
InChI=1SC23H22N2O6c129211316(1119(1424)22(26)25793010825)5620(21)31151732418(1217)23(27)28h261113H71015H21H3(H2728)b1911
MFCD02790541
N#CC(=Cc1ccc(c(c1)OC)OCc1cccc(c1)C(=O)O)C(=O)N1CCOCC1
ZINC000016158350
ZINC16158350
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