Vitas-M small molecule compound
3-[(2-methoxyphenyl)amino]-5,5-dimethyl-2-pentanoylcyclohex-2-en-1-one
Catalog ID
STL328270
SMILES CCCCC(=O)C1=C(Nc2ccccc2OC)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 C20H27NO3 MW 329.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H27NO3/c1-5-6-10-16(22)19-15(12-20(2,3)13-17(19)23)21-14-9-7-8-11-18(14)24-4/h7-9,11,21H,5-6,10,12-13H2,1-4H3InChIKey
DKQMQDONYLTDGD-UHFFFAOYSA-NSynonyms
3((2methoxyphenyl)amino)55dimethyl2pentanoylcyclohex2en1one
3((2methoxyphenyl)amino)55dimethyl2pentanoylcyclohex2enone
3(2METHOXYANILINO)55DIMETHYL2PENTANOYLCYCLOHEX2EN1ONE
3(2METHOXYPHENYLAMINO)55DIMETHYL2PENTANOYLCYCLOHEX2ENONE
CCCCC(=O)C1=C(CC(CC1=O)(C)C)NC2=CC=CC=C2OC
InChI=1SC20H27NO3c1561016(22)1915(1220(23)1317(19)23)21149781118(14)244h791121H56101213H214H3
MFCD02162161
ZINC000100730384
ZINC100730384
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