Vitas-M small molecule compound
(2E)-4-[(4-methoxyphenyl)amino]-2-methyl-4-oxobut-2-enoic acid
Catalog ID
STK428606
SMILES COc1ccc(cc1)NC(=O)/C=C(/C(=O)O)\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 C12H13NO4 MW 235.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H13NO4/c1-8(12(15)16)7-11(14)13-9-3-5-10(17-2)6-4-9/h3-7H,1-2H3,(H,13,14)(H,15,16)/b8-7+InChIKey
HJBJZXFERXIWSC-BQYQJAHWSA-NSynonyms
(2E)3(N(4METHOXYPHENYL)CARBAMOYL)2METHYLPROP2ENOICACID
(2E)4((4methoxyphenyl)amino)2methyl4oxobut2enoicacid
(E)4(4METHOXYANILINO)2METHYL4OXOBUT2ENOICACID
CC(=CC(=O)NC1=CC=C(C=C1)OC)C(=O)O
COc1ccc(cc1)NC(=O)C=C(C(=O)O)C
InChI=1SC12H13NO4c18(12(15)16)711(14)1393510(172)649h37H12H3(H1314)(H1516)b87+
MFCD03465240
ZINC000005827754
ZINC5827754
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