Vitas-M small molecule compound
(2Z)-4-[(4-ethylphenyl)amino]-3-methyl-4-oxobut-2-enoic acid
Catalog ID
STK409388
SMILES CCc1ccc(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 C13H15NO3 MW 233.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H15NO3/c1-3-10-4-6-11(7-5-10)14-13(17)9(2)8-12(15)16/h4-8H,3H2,1-2H3,(H,14,17)(H,15,16)/b9-8-InChIKey
HBAQBIDLFGHHKV-HJWRWDBZSA-NSynonyms
(2Z)3(N(4ETHYLPHENYL)CARBAMOYL)BUT2ENOICACID
(2Z)4((4ethylphenyl)amino)3methyl4oxobut2enoicacid
(Z)4(4ethylanilino)3methyl4oxobut2enoicacid
CCC1=CC=C(C=C1)NC(=O)C(=CC(=O)O)C
CCc1ccc(cc1)NC(=O)C(=CC(=O)O)C
InChI=1SC13H15NO3c13104611(7510)1413(17)9(2)812(15)16h48H3H212H3(H1417)(H1516)b98
MFCD07468413
ZINC000011566355
ZINC11566355
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