1-[(5-ethanoylthiophen-3-yl)methyl]-N-[3-(3-methoxyphenyl)phenyl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(5-ethanoylthiophen-3-yl)methyl]-N-[3-(3-methoxyphenyl)phenyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[(5-acetyl-3-thienyl)methyl]-N-[3-(3-methoxyphenyl)phenyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[(5-acetyl-3-thiophenyl)methyl]-N-[3-(3-methoxyphenyl)phenyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(5-acetylthiophen-3-yl)methyl]-N-[3-(3-methoxyphenyl)phenyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-[(5-acetyl-3-thienyl)methyl]-N-[3-(3-methoxyphenyl)phenyl]piperidin-1-ium-4-carboxamide Formula: C26H29N2O3S+ MolecularWeight: 449.58506

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CS1)C[NH+]2CCC(CC2)C(=O)NC3=CC=CC(=C3)C4=CC(=CC=C4)OC

Isomeric SMILES

CC(=O)C1=CC(=CS1)C[NH+]2CCC(CC2)C(=O)NC3=CC=CC(=C3)C4=CC(=CC=C4)OC

InChI

InChI=1S/C26H28N2O3S/c1-18(29)25-13-19(17-32-25)16-28-11-9-20(10-12-28)26(30)27-23-7-3-5-21(14-23)22-6-4-8-24(15-22)31-2/h3-8,13-15,17,20H,9-12,16H2,1-2H3,(H,27,30)/p+1