3-chloranyl-N-[(2R)-2-(furan-2-yl)-2-(4-methylpiperidin-1-ium-1-yl)ethyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[(2R)-2-(furan-2-yl)-2-(4-methylpiperidin-1-ium-1-yl)ethyl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[(2R)-2-(2-furyl)-2-(4-methylpiperidin-1-ium-1-yl)ethyl]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[(2R)-2-(2-furanyl)-2-(4-methyl-1-piperidin-1-iumyl)ethyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[(2R)-2-(furan-2-yl)-2-(4-methylpiperidin-1-ium-1-yl)ethyl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[(2R)-2-(2-furyl)-2-(4-methylpiperidin-1-ium-1-yl)ethyl]benzothiophene-2-carboxamide Formula: C21H24ClN2O2S+ MolecularWeight: 403.94546

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)C(CNC(=O)C2=C(C3=CC=CC=C3S2)Cl)C4=CC=CO4

Isomeric SMILES

CC1CC[NH+](CC1)[C@H](CNC(=O)C2=C(C3=CC=CC=C3S2)Cl)C4=CC=CO4

InChI

InChI=1S/C21H23ClN2O2S/c1-14-8-10-24(11-9-14)16(17-6-4-12-26-17)13-23-21(25)20-19(22)15-5-2-3-7-18(15)27-20/h2-7,12,14,16H,8-11,13H2,1H3,(H,23,25)/p+1/t16-/m1/s1