(5S)-5-ethyl-N-(1-methylpiperidin-1-ium-4-yl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide

Systemtic Name: (5S)-5-ethyl-N-(1-methylpiperidin-1-ium-4-yl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Openeye Name: (5S)-5-ethyl-N-(1-methylpiperidin-1-ium-4-yl)-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide CAS Name: (5S)-5-ethyl-N-(1-methyl-4-piperidin-1-iumyl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide IUPAC Name: (5S)-5-ethyl-N-(1-methylpiperidin-1-ium-4-yl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Traditional Name: (5S)-5-ethyl-N-(1-methylpiperidin-1-ium-4-yl)-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide Formula: C17H27N2OS+ MolecularWeight: 307.47408

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC2=C(C1)C=C(S2)C(=O)NC3CC[NH+](CC3)C

Isomeric SMILES

CC[C@H]1CCC2=C(C1)C=C(S2)C(=O)NC3CC[NH+](CC3)C

InChI

InChI=1S/C17H26N2OS/c1-3-12-4-5-15-13(10-12)11-16(21-15)17(20)18-14-6-8-19(2)9-7-14/h11-12,14H,3-10H2,1-2H3,(H,18,20)/p+1/t12-/m0/s1