Vitas-M small molecule compound
3-methyl-5-[(3-methylphenyl)amino]-5-oxopentanoic acid
Catalog ID
STK446072
SMILES CC(CC(=O)O)CC(=O)Nc1cccc(c1)C
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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 C13H17NO3 MW 235.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H17NO3/c1-9-4-3-5-11(6-9)14-12(15)7-10(2)8-13(16)17/h3-6,10H,7-8H2,1-2H3,(H,14,15)(H,16,17)InChIKey
JLLSKJKFCAHRGF-UHFFFAOYSA-NSynonyms
3METHYL4(N(3METHYLPHENYL)CARBAMOYL)BUTANOICACID
3methyl5((3methylphenyl)amino)5oxopentanoicacid
3METHYL5(3METHYLANILINO)5OXOPENTANOICACID
CC1=CC(=CC=C1)NC(=O)CC(C)CC(=O)O
InChI=1SC13H17NO3c1943511(69)1412(15)710(2)813(16)17h3610H78H212H3(H1415)(H1617)
MFCD03613444
ZINC000000466202
ZINC000000466203
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