Vitas-M small molecule compound
(2Z)-4-[(2,4-dimethylphenyl)amino]-4-oxobut-2-enoic acid
Catalog ID
STK086830
SMILES O=C(Nc1ccc(cc1C)C)/C=C\C(=O)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 C12H13NO3 MW 219.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H13NO3/c1-8-3-4-10(9(2)7-8)13-11(14)5-6-12(15)16/h3-7H,1-2H3,(H,13,14)(H,15,16)/b6-5-InChIKey
YJSWFYKQDVWJSU-WAYWQWQTSA-NSynonyms
7253-68-1(2Z)4((24DIMETHYLPHENYL)AMINO)4OXOBUT2ENOICACID
(Z)4(24DIMETHYLANILINO)4OXOBUT2ENOICACID
7253681
CC1=CC(=C(C=C1)NC(=O)C=CC(=O)O)C
InChI=1SC12H13NO3c183410(9(2)78)1311(14)5612(15)16h37H12H3(H1314)(H1516)b65
MFCD00134736
O=C(Nc1ccc(cc1C)C)C=CC(=O)O
STK086830
ZINC000000053895
ZINC000030728450
ZINC30728450
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