Vitas-M small molecule compound

methyl 2-{[(4-bromophenyl)carbonyl]amino}-4,5-dimethoxybenzoate

Catalog ID
STK151044
SMILES COC(=O)c1cc(OC)c(cc1NC(=O)c1ccc(cc1)Br)OC

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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 C17H16BrNO5 MW 394.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16BrNO5/c1-22-14-8-12(17(21)24-3)13(9-15(14)23-2)19-16(20)10-4-6-11(18)7-5-10/h4-9H,1-3H3,(H,19,20)
InChIKey
LAPJDMVANNQENQ-UHFFFAOYSA-N
Synonyms

COC1=C(C=C(C(=C1)C(=O)OC)NC(=O)C2=CC=C(C=C2)Br)OC
InChI=1SC17H16BrNO5c12214812(17(21)243)13(915(14)232)1916(20)104611(18)7510h49H13H3(H1920)
METHYL2(((4BROMOPHENYL)CARBONYL)AMINO)45DIMETHOXYBENZOATE
METHYL2((4BROMOBENZOYL)AMINO)45DIMETHOXYBENZOATE
MFCD03718074
ZINC000001120426
ZINC01120426
ZINC1120426

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Available files

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