Vitas-M small molecule compound

8-cyclopentylidene-2-(4-methoxyphenyl)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione

Catalog ID
STK710011
SMILES COc1ccc(cc1)N1C(=O)C2C(C1=O)C1C(=C3CCCC3)C2C=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 C21H21NO3 MW 335.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21NO3/c1-25-14-8-6-13(7-9-14)22-20(23)18-15-10-11-16(19(18)21(22)24)17(15)12-4-2-3-5-12/h6-11,15-16,18-19H,2-5H2,1H3
InChIKey
ZMHXJAAVBPMAPI-UHFFFAOYSA-N
Synonyms

(3aR4R7S7aS)8cyclopentylidene2(4methoxyphenyl)3a477atetrahydro1H47methanoisoindole13(2H)dione
8CYCLOPENTYLIDENE2(4METHOXYPHENYL)3A477ATETRAHYDRO1H47METHANOISOINDOLE13(2H)DIONE
COC1=CC=C(C=C1)N2C(=O)C3C4C=CC(C3C2=O)C4=C5CCCC5
InChI=1SC21H21NO3c125148613(7914)2220(23)1815101116(19(18)21(22)24)17(15)12423512h61115161819H25H21H3
ISOINDOLE13(1H3H)DIONE3A477ATETRAHYDRO47(CYCLOPENTYLIDENE)METHANO2(4METHOXYPHENYL)
MFCD01031843
ZINC000101127828
ZINC000101127833

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Available files

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