Vitas-M small molecule compound
6-(2,3-dihydro-1H-inden-5-ylcarbamoyl)-3,4-dimethylcyclohex-3-ene-1-carboxylic acid
Catalog ID
STK454812
SMILES O=C(C1CC(=C(CC1C(=O)O)C)C)Nc1ccc2c(c1)CCC2
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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 C19H23NO3 MW 313.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H23NO3/c1-11-8-16(17(19(22)23)9-12(11)2)18(21)20-15-7-6-13-4-3-5-14(13)10-15/h6-7,10,16-17H,3-5,8-9H2,1-2H3,(H,20,21)(H,22,23)InChIKey
OCJGRKZKQSBPLD-UHFFFAOYSA-NSynonyms
6(23dihydro1Hinden5ylcarbamoyl)34dimethylcyclohex3ene1carboxylicacid
6(NINDAN5YLCARBAMOYL)34DIMETHYLCYCLOHEX3ENECARBOXYLICACID
CC1=C(CC(C(C1)C(=O)NC2=CC3=C(CCC3)C=C2)C(=O)O)C
InChI=1SC19H23NO3c111816(17(19(22)23)912(11)2)18(21)2015761343514(13)1015h67101617H3589H212H3(H2021)(H2223)
MFCD04228316
ZINC000006848948
ZINC000006848964
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