Vitas-M small molecule compound
2-[1-(4-methoxyphenyl)-4-methyl-3-oxopentyl]-1H-indene-1,3(2H)-dione
Catalog ID
STL328724
SMILES COc1ccc(cc1)C(C1C(=O)c2c(C1=O)cccc2)CC(=O)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 C22H22O4 MW 350.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22O4/c1-13(2)19(23)12-18(14-8-10-15(26-3)11-9-14)20-21(24)16-6-4-5-7-17(16)22(20)25/h4-11,13,18,20H,12H2,1-3H3InChIKey
HKSWDAORORWPGM-UHFFFAOYSA-NSynonyms
2(1(4methoxyphenyl)4methyl3oxopentyl)1Hindene13(2H)dione
2(1(4METHOXYPHENYL)4METHYL3OXOPENTYL)INDENE13DIONE
CC(C)C(=O)CC(C1C(=O)C2=CC=CC=C2C1=O)C3=CC=C(C=C3)OC
InChI=1SC22H22O4c113(2)19(23)1218(1481015(263)11914)2021(24)16645717(16)22(20)25h411131820H12H213H3
MFCD00183816
ZINC000100366598
ZINC000100366601
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