Vitas-M small molecule compound

ethyl 4-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-ethanoisoindol-2-yl)benzoate

Catalog ID
STK279119
SMILES CCOC(=O)c1ccc(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 C19H19NO4 MW 325.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19NO4/c1-2-24-19(23)13-7-9-14(10-8-13)20-17(21)15-11-3-4-12(6-5-11)16(15)18(20)22/h3-4,7-12,15-16H,2,5-6H2,1H3
InChIKey
ZGRKVGLUUAHRTJ-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=CC=C(C=C1)N2C(=O)C3C4CCC(C3C2=O)C=C4
ETHYL4(13DIOXO133A477AHEXAHYDRO2H47ETHANOISOINDOL2YL)BENZOATE
InChI=1SC19H19NO4c122419(23)137914(10813)2017(21)15113412(6511)16(15)18(20)22h347121516H256H21H3
MFCD00741747
ZINC000100024516
ZINC000101357455

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.