Vitas-M small molecule compound
4-(2-methylbutan-2-yl)phenyl 3-(5-methyl-1,3-dioxooctahydro-2H-isoindol-2-yl)benzoate
Catalog ID
STK264567
SMILES CCC(c1ccc(cc1)OC(=O)c1cccc(c1)N1C(=O)C2C(C1=O)CC(CC2)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 C27H31NO4 MW 433.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H31NO4/c1-5-27(3,4)19-10-12-21(13-11-19)32-26(31)18-7-6-8-20(16-18)28-24(29)22-14-9-17(2)15-23(22)25(28)30/h6-8,10-13,16-17,22-23H,5,9,14-15H2,1-4H3InChIKey
LDFZKOYCRHBCOW-UHFFFAOYSA-NSynonyms
(4(2methylbutan2yl)phenyl)3(5methyl13dioxo3a45677ahexahydroisoindol2yl)benzoate
4(2methylbutan2yl)phenyl3(5methyl13dioxooctahydro2Hisoindol2yl)benzoate
CCC(C)(C)C1=CC=C(C=C1)OC(=O)C2=CC(=CC=C2)N3C(=O)C4CCC(CC4C3=O)C
InChI=1SC27H31NO4c1527(34)19101221(131119)3226(31)1876820(1618)2824(29)2214917(2)1523(22)25(28)30h68101316172223H591415H214H3
MFCD06194608
ZINC000018244593
ZINC000239135363
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