Vitas-M small molecule compound

2-{[(3-carboxy-2,2-dimethylcyclopropyl)carbonyl]amino}benzoic acid

Catalog ID
STL160852
SMILES O=C(C1C(C1(C)C)C(=O)O)Nc1ccccc1C(=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 C14H15NO5 MW 277.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H15NO5/c1-14(2)9(10(14)13(19)20)11(16)15-8-6-4-3-5-7(8)12(17)18/h3-6,9-10H,1-2H3,(H,15,16)(H,17,18)(H,19,20)
InChIKey
LQIJYEKRRQNNNT-UHFFFAOYSA-N
Synonyms
1282142-10-2
1282142102
2(((3carboxy22dimethylcyclopropyl)carbonyl)amino)benzoicacid
2((3carboxy22dimethylcyclopropanecarbonyl)amino)benzoicacid
2(3carboxy22dimethylcyclopropanecarboxamido)benzoicacid
CC1(C(C1C(=O)O)C(=O)NC2=CC=CC=C2C(=O)O)C
InChI=1SC14H15NO5c114(2)9(10(14)13(19)20)11(16)15864357(8)12(17)18h36910H12H3(H1516)(H1718)(H1920)
MFCD18799979
ZINC000061721675
ZINC000061721678

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Available files

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