N-[5-methyl-3-(phenylcarbonyl)thiophen-2-yl]-2-piperidin-1-ium-1-yl-ethanamide

Systemtic Name: N-[5-methyl-3-(phenylcarbonyl)thiophen-2-yl]-2-piperidin-1-ium-1-yl-ethanamide Openeye Name: N-(3-benzoyl-5-methyl-2-thienyl)-2-piperidin-1-ium-1-yl-acetamide CAS Name: N-(3-benzoyl-5-methyl-2-thiophenyl)-2-(1-piperidin-1-iumyl)acetamide IUPAC Name: N-(3-benzoyl-5-methylthiophen-2-yl)-2-piperidin-1-ium-1-ylacetamide Traditional Name: N-(3-benzoyl-5-methyl-2-thienyl)-2-piperidin-1-ium-1-yl-acetamide Formula: C19H23N2O2S+ MolecularWeight: 343.46312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)NC(=O)C[NH+]2CCCCC2)C(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(S1)NC(=O)C[NH+]2CCCCC2)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H22N2O2S/c1-14-12-16(18(23)15-8-4-2-5-9-15)19(24-14)20-17(22)13-21-10-6-3-7-11-21/h2,4-5,8-9,12H,3,6-7,10-11,13H2,1H3,(H,20,22)/p+1