Vitas-M small molecule compound
2-[3-(hexyloxy)phenyl]-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylic acid
Catalog ID
STK287502
SMILES CCCCCCOc1cccc(c1)N1C(=O)c2c(C1=O)cc(cc2)C(=O)O
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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 C21H21NO5 MW 367.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21NO5/c1-2-3-4-5-11-27-16-8-6-7-15(13-16)22-19(23)17-10-9-14(21(25)26)12-18(17)20(22)24/h6-10,12-13H,2-5,11H2,1H3,(H,25,26)InChIKey
IODUCBMOEMIBBE-UHFFFAOYSA-NSynonyms
2(3(hexyloxy)phenyl)13dioxo23dihydro1Hisoindole5carboxylicacid
2(3HEXOXYPHENYL)13DIOXOISOINDOLE5CARBOXYLICACID
CCCCCCOC1=CC=CC(=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)O
InChI=1SC21H21NO5c1234511271686715(1316)2219(23)1710914(21(25)26)1218(17)20(22)24h6101213H2511H21H3(H2526)
MFCD04061848
ZINC000004654008
ZINC4654008
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