Vitas-M small molecule compound

3-{[(3-bromophenyl)carbonyl]amino}-3-(4-methoxyphenyl)propanoic acid

Catalog ID
STK680009
SMILES COc1ccc(cc1)C(NC(=O)c1cccc(c1)Br)CC(=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 C17H16BrNO4 MW 378.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16BrNO4/c1-23-14-7-5-11(6-8-14)15(10-16(20)21)19-17(22)12-3-2-4-13(18)9-12/h2-9,15H,10H2,1H3,(H,19,22)(H,20,21)
InChIKey
GOKBMEATXAZWRF-UHFFFAOYSA-N
Synonyms

(3R)3((3BROMOBENZOYL)AMINO)3(4METHOXYPHENYL)PROPANOICACID
3(((3bromophenyl)carbonyl)amino)3(4methoxyphenyl)propanoicacid
3((3BROMOBENZOYL)AMINO)3(4METHOXYPHENYL)PROPANOICACID
3((3BROMOPHENYL)CARBONYLAMINO)3(4METHOXYPHENYL)PROPANOICACID
COC1=CC=C(C=C1)C(CC(=O)O)NC(=O)C2=CC(=CC=C2)Br
InChI=1SC17H16BrNO4c123147511(6814)15(1016(20)21)1917(22)1232413(18)912h2915H10H21H3(H1922)(H2021)
MFCD03761291
ZINC000004580708
ZINC000004580709

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Available files

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