Vitas-M small molecule compound
2-{[(2-bromophenyl)carbonyl]amino}-4,5-dimethoxybenzoic acid
Catalog ID
STK077176
SMILES COc1cc(NC(=O)c2ccccc2Br)c(cc1OC)C(=O)O
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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 C16H14BrNO5 MW 380.19 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14BrNO5/c1-22-13-7-10(16(20)21)12(8-14(13)23-2)18-15(19)9-5-3-4-6-11(9)17/h3-8H,1-2H3,(H,18,19)(H,20,21)InChIKey
KUKKMKSUWNUXOO-UHFFFAOYSA-NSynonyms
2(((2BROMOPHENYL)CARBONYL)AMINO)45DIMETHOXYBENZOICACID
2((2BROMOBENZOYL)AMINO)45DIMETHOXYBENZOICACID
COC1=C(C=C(C(=C1)C(=O)O)NC(=O)C2=CC=CC=C2Br)OC
COc1cc(NC(=O)c2ccccc2Br)c(cc1OC)C(=O)O
InChI=1SC16H14BrNO5c12213710(16(20)21)12(814(13)232)1815(19)9534611(9)17h38H12H3(H1819)(H2021)
MFCD02031567
STK077176
ZINC000004600601
ZINC4600601
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