Vitas-M small molecule compound

ethyl 5-(acetyloxy)-6-bromo-1-butyl-2-methyl-1H-indole-3-carboxylate

Catalog ID
STK759677
SMILES CCCCn1c(C)c(c2c1cc(Br)c(c2)OC(=O)C)C(=O)OCC

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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 C18H22BrNO4 MW 396.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22BrNO4/c1-5-7-8-20-11(3)17(18(22)23-6-2)13-9-16(24-12(4)21)14(19)10-15(13)20/h9-10H,5-8H2,1-4H3
InChIKey
GPRDEADSMOAZEB-UHFFFAOYSA-N
Synonyms
312513-30-7
312513307
CCCCN1C(=C(C2=CC(=C(C=C21)Br)OC(=O)C)C(=O)OCC)C
ethyl5(acetyloxy)6bromo1butyl2methyl1Hindole3carboxylate
ethyl5acetoxy6bromo1butyl2methyl1Hindole3carboxylate
ETHYL5ACETYLOXY6BROMO1BUTYL2METHYLINDOLE3CARBOXYLATE
InChI=1SC18H22BrNO4c15782011(3)17(18(22)2362)13916(2412(4)21)14(19)1015(13)20h910H58H214H3
MFCD00385852
ZINC000002211117
ZINC02211117
ZINC2211117

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.