Vitas-M small molecule compound
3-{[3-(acetylamino)phenyl]carbamoyl}bicyclo[2.2.1]heptane-2-carboxylic acid
Catalog ID
STK479767
SMILES CC(=O)Nc1cccc(c1)NC(=O)C1C2CCC(C1C(=O)O)C2
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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 C17H20N2O4 MW 316.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20N2O4/c1-9(20)18-12-3-2-4-13(8-12)19-16(21)14-10-5-6-11(7-10)15(14)17(22)23/h2-4,8,10-11,14-15H,5-7H2,1H3,(H,18,20)(H,19,21)(H,22,23)InChIKey
MRNPQSVWVSKEAR-UHFFFAOYSA-NSynonyms
2((3ACETAMIDOPHENYL)CARBAMOYL)BICYCLO(221)HEPTANE3CARBOXYLICACID
3((3(acetylamino)phenyl)carbamoyl)bicyclo(221)heptane2carboxylicacid
3(N(3(ACETYLAMINO)PHENYL)CARBAMOYL)BICYCLO(221)HEPTANE2CARBOXYLICACID
CC(=O)NC1=CC=CC(=C1)NC(=O)C2C3CCC(C3)C2C(=O)O
InChI=1SC17H20N2O4c19(20)181232413(812)1916(21)14105611(710)15(14)17(22)23h24810111415H57H21H3(H1820)(H1921)(H2223)
MFCD06063920
ZINC000101459768
ZINC000136309959
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