Vitas-M small molecule compound
3-methyl-4-{[(E)-(3-methyl-2-oxocyclohexylidene)methyl]amino}benzoic acid
Catalog ID
STL363789
SMILES O=C1C(C)CCC/C/1=C\Nc1ccc(cc1C)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 C16H19NO3 MW 273.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H19NO3/c1-10-4-3-5-13(15(10)18)9-17-14-7-6-12(16(19)20)8-11(14)2/h6-10,17H,3-5H2,1-2H3,(H,19,20)/b13-9+InChIKey
GLDFXSBXUAWNSW-UKTHLTGXSA-NSynonyms
1164484-18-7(E)3methyl4(((3methyl2oxocyclohexylidene)methyl)amino)benzoicacid
1164484187
3methyl4(((E)(3methyl2oxocyclohexylidene)methyl)amino)benzoicacid
3METHYL4((3METHYL2OXOCYCLOHEX(E)YLIDENEMETHYL)AMINO)BENZOICACID
CC1CCCC(=CNC2=C(C=C(C=C2)C(=O)O)C)C1=O
InChI=1SC16H19NO3c11043513(15(10)18)917147612(16(19)20)811(14)2h61017H35H212H3(H1920)b139+
MFCD04024761
O=C1C(C)CCCC1=CNc1ccc(cc1C)C(=O)O
ZINC000000531126
ZINC000018208078
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