1-[(5-ethanoylthiophen-3-yl)methyl]-N-(6-phenoxypyridin-3-yl)piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(5-ethanoylthiophen-3-yl)methyl]-N-(6-phenoxypyridin-3-yl)piperidin-1-ium-4-carboxamide Openeye Name: 1-[(5-acetyl-3-thienyl)methyl]-N-(6-phenoxy-3-pyridyl)piperidin-1-ium-4-carboxamide CAS Name: 1-[(5-acetyl-3-thiophenyl)methyl]-N-(6-phenoxy-3-pyridinyl)-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(5-acetylthiophen-3-yl)methyl]-N-(6-phenoxypyridin-3-yl)piperidin-1-ium-4-carboxamide Traditional Name: 1-[(5-acetyl-3-thienyl)methyl]-N-(6-phenoxy-3-pyridyl)piperidin-1-ium-4-carboxamide Formula: C24H26N3O3S+ MolecularWeight: 436.54654

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CS1)C[NH+]2CCC(CC2)C(=O)NC3=CN=C(C=C3)OC4=CC=CC=C4

Isomeric SMILES

CC(=O)C1=CC(=CS1)C[NH+]2CCC(CC2)C(=O)NC3=CN=C(C=C3)OC4=CC=CC=C4

InChI

InChI=1S/C24H25N3O3S/c1-17(28)22-13-18(16-31-22)15-27-11-9-19(10-12-27)24(29)26-20-7-8-23(25-14-20)30-21-5-3-2-4-6-21/h2-8,13-14,16,19H,9-12,15H2,1H3,(H,26,29)/p+1