ethyl 4-fluoranyl-3-[[4-(methylcarbamoyl)piperidin-1-ium-1-yl]methyl]-1-benzothiophene-2-carboxylate

Systemtic Name: ethyl 4-fluoranyl-3-[[4-(methylcarbamoyl)piperidin-1-ium-1-yl]methyl]-1-benzothiophene-2-carboxylate Openeye Name: ethyl 4-fluoro-3-[[4-(methylcarbamoyl)piperidin-1-ium-1-yl]methyl]benzothiophene-2-carboxylate CAS Name: 4-fluoro-3-[[4-(methylcarbamoyl)-1-piperidin-1-iumyl]methyl]-1-benzothiophene-2-carboxylic acid ethyl ester IUPAC Name: ethyl 4-fluoro-3-[[4-(methylcarbamoyl)piperidin-1-ium-1-yl]methyl]-1-benzothiophene-2-carboxylate Traditional Name: 4-fluoro-3-[[4-(methylcarbamoyl)piperidin-1-ium-1-yl]methyl]benzothiophene-2-carboxylic acid ethyl ester Formula: C19H24FN2O3S+ MolecularWeight: 379.468863

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(C=CC=C2S1)F)C[NH+]3CCC(CC3)C(=O)NC

Isomeric SMILES

CCOC(=O)C1=C(C2=C(C=CC=C2S1)F)C[NH+]3CCC(CC3)C(=O)NC

InChI

InChI=1S/C19H23FN2O3S/c1-3-25-19(24)17-13(16-14(20)5-4-6-15(16)26-17)11-22-9-7-12(8-10-22)18(23)21-2/h4-6,12H,3,7-11H2,1-2H3,(H,21,23)/p+1