N-(2-methoxyethyl)-2-[2-(4-methylpiperidin-1-ium-1-yl)ethanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: N-(2-methoxyethyl)-2-[2-(4-methylpiperidin-1-ium-1-yl)ethanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: N-(2-methoxyethyl)-2-[[2-(4-methylpiperidin-1-ium-1-yl)acetyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: N-(2-methoxyethyl)-2-[[2-(4-methyl-1-piperidin-1-iumyl)-1-oxoethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: N-(2-methoxyethyl)-2-[[2-(4-methylpiperidin-1-ium-1-yl)acetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: N-(2-methoxyethyl)-2-[[2-(4-methylpiperidin-1-ium-1-yl)acetyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C20H32N3O3S+ MolecularWeight: 394.55138

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CC(=O)NC2=C(C3=C(S2)CCCC3)C(=O)NCCOC

Isomeric SMILES

CC1CC[NH+](CC1)CC(=O)NC2=C(C3=C(S2)CCCC3)C(=O)NCCOC

InChI

InChI=1S/C20H31N3O3S/c1-14-7-10-23(11-8-14)13-17(24)22-20-18(19(25)21-9-12-26-2)15-5-3-4-6-16(15)27-20/h14H,3-13H2,1-2H3,(H,21,25)(H,22,24)/p+1