Vitas-M small molecule compound

ethyl 5-(6-bromo-1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)-2-chlorobenzoate

Catalog ID
STK957475
SMILES CCOC(=O)c1cc(ccc1Cl)n1c(=O)c2cccc3c2c(c1=O)ccc3Br

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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 C21H13BrClNO4 MW 458.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H13BrClNO4/c1-2-28-21(27)15-10-11(6-9-17(15)23)24-19(25)13-5-3-4-12-16(22)8-7-14(18(12)13)20(24)26/h3-10H,2H2,1H3
InChIKey
GPQDLKLACKHSHH-UHFFFAOYSA-N
Synonyms
352686-24-9
352686249
CCOC(=O)C1=C(C=CC(=C1)N2C(=O)C3=C4C(=C(C=C3)Br)C=CC=C4C2=O)Cl
ethyl5(6bromo13dioxo1Hbenzo(de)isoquinolin2(3H)yl)2chlorobenzoate
ETHYL5(6BROMO13DIOXOBENZO(DE)ISOQUINOLIN2YL)2CHLOROBENZOATE
InChI=1SC21H13BrClNO4c122821(27)151011(6917(15)23)2419(25)135341216(22)8714(18(12)13)20(24)26h310H2H21H3
MFCD01178748
ZINC000000996528
ZINC00996528
ZINC996528

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Available files

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