Vitas-M small molecule compound
4-{[1,3-dioxo-2-(tetrahydrofuran-2-ylmethyl)-2,3-dihydro-1H-isoindol-5-yl]carbonyl}benzoic acid
Catalog ID
STK224287
SMILES O=C1c2cc(ccc2C(=O)N1CC1CCCO1)C(=O)c1ccc(cc1)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 C21H17NO6 MW 379.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17NO6/c23-18(12-3-5-13(6-4-12)21(26)27)14-7-8-16-17(10-14)20(25)22(19(16)24)11-15-2-1-9-28-15/h3-8,10,15H,1-2,9,11H2,(H,26,27)InChIKey
LSNBDOKGZVRAAU-UHFFFAOYSA-NSynonyms
4((13DIOXO2(OXOLAN2YLMETHYL)BENZO(C)AZOLIDIN5YL)CARBONYL)BENZOICACID
4((13DIOXO2(TETRAHYDRO2FURANYLMETHYL)23DIHYDRO1HISOINDOL5YL)CARBONYL)BENZOICACID
4((13dioxo2(tetrahydrofuran2ylmethyl)23dihydro1Hisoindol5yl)carbonyl)benzoicacid
4(13DIOXO2(OXOLAN2YLMETHYL)ISOINDOLE5CARBONYL)BENZOICACID
C1CC(OC1)CN2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)C4=CC=C(C=C4)C(=O)O
InChI=1SC21H17NO6c2318(123513(6412)21(26)27)14781617(1014)20(25)22(19(16)24)11152192815h381015H12911H2(H2627)
MFCD01830018
ZINC000000990912
ZINC000000990913
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