Vitas-M small molecule compound
2-[(3-fluoro-4-methylphenyl)amino]-2-oxoethyl 4-tert-butylbenzoate
Catalog ID
STL013120
SMILES O=C(Nc1ccc(c(c1)F)C)COC(=O)c1ccc(cc1)C(C)(C)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 C20H22FNO3 MW 343.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22FNO3/c1-13-5-10-16(11-17(13)21)22-18(23)12-25-19(24)14-6-8-15(9-7-14)20(2,3)4/h5-11H,12H2,1-4H3,(H,22,23)InChIKey
RLRXEGPQXLPLSH-UHFFFAOYSA-NSynonyms
730252-09-2(2(3FLUORO4METHYLANILINO)2OXOETHYL)4TERTBUTYLBENZOATE
2((3fluoro4methylphenyl)amino)2oxoethyl4tertbutylbenzoate
730252092
CC1=C(C=C(C=C1)NC(=O)COC(=O)C2=CC=C(C=C2)C(C)(C)C)F
InChI=1SC20H22FNO3c11351016(1117(13)21)2218(23)122519(24)146815(9714)20(23)4h511H12H214H3(H2223)
MFCD03972311
ZINC000003296114
ZINC03296114
ZINC3296114
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