Vitas-M small molecule compound

naphthalen-2-yl 3-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)propanoate

Catalog ID
STK257687
SMILES O=C(Oc1ccc2c(c1)cccc2)CCN1C(=O)C2C(C1=O)C1CC2C=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 C22H19NO4 MW 361.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19NO4/c24-18(27-17-8-7-13-3-1-2-4-14(13)12-17)9-10-23-21(25)19-15-5-6-16(11-15)20(19)22(23)26/h1-8,12,15-16,19-20H,9-11H2
InChIKey
BTZIDJQRUXBZIL-UHFFFAOYSA-N
Synonyms

C1C2C=CC1C3C2C(=O)N(C3=O)CCC(=O)OC4=CC5=CC=CC=C5C=C4
InChI=1SC22H19NO4c2418(27178713312414(13)1217)9102321(25)19155616(1115)20(19)22(23)26h181215161920H911H2
MFCD03577445
NAPHTHALEN2YL3(13DIOXO133A477AHEXAHYDRO2H47METHANOISOINDOL2YL)PROPANOATE
ZINC000100997260
ZINC000101719874

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Available files

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