Vitas-M small molecule compound

(2Z)-4-[(4-ethylphenyl)amino]-4-oxobut-2-enoic acid

Catalog ID
STK094463
SMILES CCc1ccc(cc1)NC(=O)/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/c1-2-9-3-5-10(6-4-9)13-11(14)7-8-12(15)16/h3-8H,2H2,1H3,(H,13,14)(H,15,16)/b8-7-
InChIKey
GYUHORVVZJAIKQ-FPLPWBNLSA-N
Synonyms
55750-37-3
(2Z)4((4ETHYLPHENYL)AMINO)4OXOBUT2ENOICACID
(Z)3(4ETHYLPHENYLCARBAMOYL)ACRYLICACID
(Z)4(4ETHYLANILINO)4OXOBUT2ENOICACID
3(4ETHYLPHENYLCARBAMOYL)ACRYLICACID
55750373
CCC1=CC=C(C=C1)NC(=O)C=CC(=O)O
CCc1ccc(cc1)NC(=O)C=CC(=O)O
InChI=1SC12H13NO3c1293510(649)1311(14)7812(15)16h38H2H21H3(H1314)(H1516)b87
MFCD00020481
STK094463
ZINC000004670137
ZINC4670137

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Available files

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