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

Systemtic Name: (5S)-5-ethyl-N-(1-propan-2-ylpiperidin-1-ium-4-yl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Openeye Name: (5S)-5-ethyl-N-(1-isopropylpiperidin-1-ium-4-yl)-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide CAS Name: (5S)-5-ethyl-N-(1-propan-2-yl-4-piperidin-1-iumyl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide IUPAC Name: (5S)-5-ethyl-N-(1-propan-2-ylpiperidin-1-ium-4-yl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Traditional Name: (5S)-5-ethyl-N-(1-isopropylpiperidin-1-ium-4-yl)-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide Formula: C19H31N2OS+ MolecularWeight: 335.52724

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H30N2OS/c1-4-14-5-6-17-15(11-14)12-18(23-17)19(22)20-16-7-9-21(10-8-16)13(2)3/h12-14,16H,4-11H2,1-3H3,(H,20,22)/p+1/t14-/m0/s1