Vitas-M small molecule compound
4-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-ethanoisoindol-2-yl)phenyl acetate
Catalog ID
STK083487
SMILES CC(=O)Oc1ccc(cc1)N1C(=O)C2C(C1=O)C1CCC2C=C1
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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 C18H17NO4 MW 311.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17NO4/c1-10(20)23-14-8-6-13(7-9-14)19-17(21)15-11-2-3-12(5-4-11)16(15)18(19)22/h2-3,6-9,11-12,15-16H,4-5H2,1H3InChIKey
NUKVTKVDDZWCBT-UHFFFAOYSA-NSynonyms
4(13DIOXO133A477AHEXAHYDRO2H47ETHANOISOINDOL2YL)PHENYLACETATE
CC(=O)OC1=CC=C(C=C1)N2C(=O)C3C4CCC(C3C2=O)C=C4
CC(=O)Oc1ccc(cc1)N1C(=O)C2C(C1=O)C1CCC2C=C1
InChI=1SC18H17NO4c110(20)23148613(7914)1917(21)15112312(5411)16(15)18(19)22h236911121516H45H21H3
MFCD01176540
STK083487
ZINC000100067232
ZINC000101358014
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