Vitas-M small molecule compound
4-(1,3-dioxooctahydro-2H-isoindol-2-yl)phenyl 3-methoxybenzoate
Catalog ID
STK268859
SMILES COc1cccc(c1)C(=O)Oc1ccc(cc1)N1C(=O)C2C(C1=O)CCCC2
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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 C22H21NO5 MW 379.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21NO5/c1-27-17-6-4-5-14(13-17)22(26)28-16-11-9-15(10-12-16)23-20(24)18-7-2-3-8-19(18)21(23)25/h4-6,9-13,18-19H,2-3,7-8H2,1H3InChIKey
JFSNPZXTRNNBIJ-UHFFFAOYSA-NSynonyms
(4(13dioxo3a45677ahexahydroisoindol2yl)phenyl)3methoxybenzoate
4((3AR7AR)13DIOXOOCTAHYDRO2HISOINDOL2YL)PHENYL3METHOXYBENZOATE
4((3AS7AS)13DIOXOOCTAHYDRO2HISOINDOL2YL)PHENYL3METHOXYBENZOATE
4(13dioxooctahydro2Hisoindol2yl)phenyl3methoxybenzoate
COC1=CC=CC(=C1)C(=O)OC2=CC=C(C=C2)N3C(=O)C4CCCCC4C3=O
InChI=1SC22H21NO5c1271764514(1317)22(26)281611915(101216)2320(24)18723819(18)21(23)25h469131819H2378H21H3
MFCD01363067
ZINC000017976131
ZINC000100552558
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