Vitas-M small molecule compound
2-(4-chlorobenzyl)-3a,4,7,7a-tetrahydro-1H-4,7-ethanoisoindole-1,3(2H)-dione
Catalog ID
STK293167
SMILES O=C1C2C3CCC(C2C(=O)N1Cc1ccc(cc1)Cl)C=C3
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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 C17H16ClNO2 MW 301.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16ClNO2/c18-13-7-1-10(2-8-13)9-19-16(20)14-11-3-4-12(6-5-11)15(14)17(19)21/h1-4,7-8,11-12,14-15H,5-6,9H2InChIKey
LPHDWJWQVGENST-UHFFFAOYSA-NSynonyms
2(4CHLOROBENZYL)3A477ATETRAHYDRO1H47ETHANOISOINDOLE13(2H)DIONE
C1CC2C=CC1C3C2C(=O)N(C3=O)CC4=CC=C(C=C4)Cl
InChI=1SC17H16ClNO2c18137110(2813)91916(20)14113412(6511)15(14)17(19)21h147811121415H569H2
MFCD06621925
ZINC000100411430
ZINC000229994738
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