Vitas-M small molecule compound
3-{[4-(benzyloxy)-3-bromo-5-ethoxybenzyl]amino}-4-methylbenzoic acid
Catalog ID
STL308581
SMILES CCOc1cc(CNc2cc(ccc2C)C(=O)O)cc(c1OCc1ccccc1)Br
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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 C24H24BrNO4 MW 470.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H24BrNO4/c1-3-29-22-12-18(14-26-21-13-19(24(27)28)10-9-16(21)2)11-20(25)23(22)30-15-17-7-5-4-6-8-17/h4-13,26H,3,14-15H2,1-2H3,(H,27,28)InChIKey
HECFPCOEITVAMC-UHFFFAOYSA-NSynonyms
3((3bromo5ethoxy4phenylmethoxyphenyl)methylamino)4methylbenzoicacid
3((4(benzyloxy)3bromo5ethoxybenzyl)amino)4methylbenzoicacid
CCOC1=C(C(=CC(=C1)CNC2=C(C=CC(=C2)C(=O)O)C)Br)OCC3=CC=CC=C3
InChI=1SC24H24BrNO4c1329221218(1426211319(24(27)28)10916(21)2)1120(25)23(22)3015177546817h41326H31415H212H3(H2728)
MFCD07611525
ZINC000020880581
ZINC20880581
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