Vitas-M small molecule compound
3-(2,3-dihydro-1H-inden-5-ylcarbamoyl)-7-oxabicyclo[2.2.1]hept-5-ene-2-carboxylic acid
Catalog ID
STK474656
SMILES O=C(C1C2C=CC(C1C(=O)O)O2)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 C17H17NO4 MW 299.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17NO4/c19-16(14-12-6-7-13(22-12)15(14)17(20)21)18-11-5-4-9-2-1-3-10(9)8-11/h4-8,12-15H,1-3H2,(H,18,19)(H,20,21)InChIKey
MDZGXPLSYJJQDG-UHFFFAOYSA-NSynonyms
2(23DIHYDRO1HINDEN5YLCARBAMOYL)7OXABICYCLO(221)HEPT5ENE3CARBOXYLICACID
3(23dihydro1Hinden5ylcarbamoyl)7oxabicyclo(221)hept5ene2carboxylicacid
3(NINDAN5YLCARBAMOYL)7OXABICYCLO(221)HEPT5ENE2CARBOXYLICACID
C1CC2=C(C1)C=C(C=C2)NC(=O)C3C4C=CC(C3C(=O)O)O4
InChI=1SC17H17NO4c1916(14126713(2212)15(14)17(20)21)181154921310(9)811h481215H13H2(H1819)(H2021)
MFCD06065709
ZINC000222439501
ZINC000239347127
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