Vitas-M small molecule compound
2-butanoyl-5,5-dimethyl-3-(phenylamino)cyclohex-2-en-1-one
Catalog ID
STK805617
SMILES CCCC(=O)C1=C(Nc2ccccc2)CC(CC1=O)(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 C18H23NO2 MW 285.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H23NO2/c1-4-8-15(20)17-14(11-18(2,3)12-16(17)21)19-13-9-6-5-7-10-13/h5-7,9-10,19H,4,8,11-12H2,1-3H3InChIKey
PQNQEHPDGRLRDZ-UHFFFAOYSA-NSynonyms
2butanoyl55dimethyl3(phenylamino)cyclohex2en1one
2butyryl55dimethyl3(phenylamino)cyclohex2enone
2BUTYRYL55DIMETHYL3PHENYLAMINOCYCLOHEX2ENONE
3ANILINO2BUTANOYL55DIMETHYLCYCLOHEX2EN1ONE
CCCC(=O)C1=C(CC(CC1=O)(C)C)NC2=CC=CC=C2
InChI=1SC18H23NO2c14815(20)1714(1118(23)1216(17)21)191396571013h5791019H481112H213H3
MFCD00512997
ZINC000000287244
ZINC00287244
ZINC287244
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