Vitas-M small molecule compound
4-{[(2,4,5-trimethoxybenzyl)amino]methyl}benzoic acid
Catalog ID
STK728733
SMILES COc1cc(OC)c(cc1CNCc1ccc(cc1)C(=O)O)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 C18H21NO5 MW 331.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21NO5/c1-22-15-9-17(24-3)16(23-2)8-14(15)11-19-10-12-4-6-13(7-5-12)18(20)21/h4-9,19H,10-11H2,1-3H3,(H,20,21)InChIKey
OATSOSBSZKXORJ-UHFFFAOYSA-NSynonyms
4(((245trimethoxybenzyl)amino)methyl)benzoicacid
4(((245trimethoxybenzyl)amino)methyl)benzoicacidhydrochloride
4(((245TRIMETHOXYPHENYL)METHYLAMINO)METHYL)BENZOICACID
COC1=CC(=C(C=C1CNCC2=CC=C(C=C2)C(=O)O)OC)OC
COc1cc(OC)c(cc1CNCc1ccc(cc1)C(=O)O)OCCl
InChI=1SC18H21NO5c12215917(243)16(232)814(15)111910124613(7512)18(20)21h4919H1011H213H3(H2021)
MFCD06778900
ZINC000005303410
ZINC05303410
ZINC5303410
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