Vitas-M small molecule compound
(2Z)-4-[(2-methoxy-5-methylphenyl)amino]-4-oxobut-2-enoic acid
Catalog ID
STK364612
SMILES COc1ccc(cc1NC(=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/c1-8-3-4-10(17-2)9(7-8)13-11(14)5-6-12(15)16/h3-7H,1-2H3,(H,13,14)(H,15,16)/b6-5-InChIKey
SDPZPTWZENTROE-WAYWQWQTSA-NSynonyms
(2Z)4((2METHOXY5METHYLPHENYL)AMINO)4OXOBUT2ENOICACID
(Z)4(2METHOXY5METHYLANILINO)4OXOBUT2ENOICACID
CC1=CC(=C(C=C1)OC)NC(=O)C=CC(=O)O
COc1ccc(cc1NC(=O)C=CC(=O)O)C
InChI=1SC12H13NO4c183410(172)9(78)1311(14)5612(15)16h37H12H3(H1314)(H1516)b65
MFCD00134742
ZINC000004499077
ZINC4499077
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