3-chloranyl-4-fluoranyl-N-(2-piperidin-1-ium-1-ylethyl)-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-4-fluoranyl-N-(2-piperidin-1-ium-1-ylethyl)-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-4-fluoro-N-(2-piperidin-1-ium-1-ylethyl)benzothiophene-2-carboxamide CAS Name: 3-chloro-4-fluoro-N-[2-(1-piperidin-1-iumyl)ethyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-4-fluoro-N-(2-piperidin-1-ium-1-ylethyl)-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-4-fluoro-N-(2-piperidin-1-ium-1-ylethyl)benzothiophene-2-carboxamide Formula: C16H19ClFN2OS+ MolecularWeight: 341.851263

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCNC(=O)C2=C(C3=C(C=CC=C3S2)F)Cl

Isomeric SMILES

C1CC[NH+](CC1)CCNC(=O)C2=C(C3=C(C=CC=C3S2)F)Cl

InChI

InChI=1S/C16H18ClFN2OS/c17-14-13-11(18)5-4-6-12(13)22-15(14)16(21)19-7-10-20-8-2-1-3-9-20/h4-6H,1-3,7-10H2,(H,19,21)/p+1