Vitas-M small molecule compound

2-(5-acetyl-2-ethoxyphenyl)-8-(propan-2-ylidene)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione

Catalog ID
STK258093
SMILES CCOc1ccc(cc1N1C(=O)C2C(C1=O)C1C(=C(C)C)C2C=C1)C(=O)C

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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 C22H23NO4 MW 365.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23NO4/c1-5-27-17-9-6-13(12(4)24)10-16(17)23-21(25)19-14-7-8-15(18(14)11(2)3)20(19)22(23)26/h6-10,14-15,19-20H,5H2,1-4H3
InChIKey
QUGHVESQNBDHPS-UHFFFAOYSA-N
Synonyms
1005130-10-8
1005130108
2(5ACETYL2ETHOXYPHENYL)8(1METHYLETHYLIDENE)3A477ATETRAHYDRO1H47METHANOISOINDOLE13DIONE
2(5acetyl2ethoxyphenyl)8(propan2ylidene)3a477atetrahydro1H47methanoisoindole13(2H)dione
CCOC1=C(C=C(C=C1)C(=O)C)N2C(=O)C3C4C=CC(C3C2=O)C4=C(C)C
InChI=1SC22H23NO4c1527179613(12(4)24)1016(17)2321(25)19147815(18(14)11(2)3)20(19)22(23)26h61014151920H5H214H3
MFCD01802291
ZINC000100844250
ZINC000100844262

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Available files

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