Vitas-M small molecule compound
2-(3-bromophenyl)-10-chloro-3a,4,9,9a-tetrahydro-1H-4,9-ethenobenzo[f]isoindole-1,3(2H)-dione
Catalog ID
STK752508
SMILES Brc1cccc(c1)N1C(=O)C2C(C1=O)C1C(=CC2c2c1cccc2)Cl
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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 C20H13BrClNO2 MW 414.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H13BrClNO2/c21-10-4-3-5-11(8-10)23-19(24)17-14-9-15(22)16(18(17)20(23)25)13-7-2-1-6-12(13)14/h1-9,14,16-18HInChIKey
MCKXPDXJJQJJHD-UHFFFAOYSA-NSynonyms
2(3bromophenyl)10chloro3a499atetrahydro1H49ethenobenzo(f)isoindole13(2H)dione
C1=CC=C2C3C4C(C(C2=C1)C=C3Cl)C(=O)N(C4=O)C5=CC(=CC=C5)Br
InChI=1SC20H13BrClNO2c211043511(810)2319(24)1714915(22)16(18(17)20(23)25)13721612(13)14h19141618H
MFCD00684695
ZINC000100046129
ZINC000169616481
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