Vitas-M small molecule compound
(2E)-4-[tert-butyl(4-methylbenzyl)amino]-4-oxobut-2-enoic acid
Catalog ID
STK025092
SMILES O=C(N(C(C)(C)C)Cc1ccc(cc1)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 C16H21NO3 MW 275.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H21NO3/c1-12-5-7-13(8-6-12)11-17(16(2,3)4)14(18)9-10-15(19)20/h5-10H,11H2,1-4H3,(H,19,20)/b10-9+InChIKey
RMMPSKPOPVXBHU-MDZDMXLPSA-NSynonyms
313496-13-8(2E)4(TERTBUTYL(4METHYLBENZYL)AMINO)4OXOBUT2ENOICACID
(E)4(TERTBUTYL((4METHYLPHENYL)METHYL)AMINO)4OXOBUT2ENOICACID
(E)4(tertbutyl(4methylbenzyl)amino)4oxobut2enoicacid
313496138
CC1=CC=C(C=C1)CN(C(=O)C=CC(=O)O)C(C)(C)C
InChI=1SC16H21NO3c1125713(8612)1117(16(23)4)14(18)91015(19)20h510H11H214H3(H1920)b109+
MFCD00426533
O=C(N(C(C)(C)C)Cc1ccc(cc1)C)C=CC(=O)O
STK025092
ZINC000002023896
ZINC2023896
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