3-chloranyl-N-(1-ethylpiperidin-1-ium-4-yl)-6-methyl-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-(1-ethylpiperidin-1-ium-4-yl)-6-methyl-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-(1-ethylpiperidin-1-ium-4-yl)-6-methyl-benzothiophene-2-carboxamide CAS Name: 3-chloro-N-(1-ethyl-4-piperidin-1-iumyl)-6-methyl-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-(1-ethylpiperidin-1-ium-4-yl)-6-methyl-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-(1-ethylpiperidin-1-ium-4-yl)-6-methyl-benzothiophene-2-carboxamide Formula: C17H22ClN2OS+ MolecularWeight: 337.88738

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCC(CC1)NC(=O)C2=C(C3=C(S2)C=C(C=C3)C)Cl

Isomeric SMILES

CC[NH+]1CCC(CC1)NC(=O)C2=C(C3=C(S2)C=C(C=C3)C)Cl

InChI

InChI=1S/C17H21ClN2OS/c1-3-20-8-6-12(7-9-20)19-17(21)16-15(18)13-5-4-11(2)10-14(13)22-16/h4-5,10,12H,3,6-9H2,1-2H3,(H,19,21)/p+1