2-ethyl-1-[(2-methoxyphenyl)methyl]-6-methyl-4-oxidanylidene-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]pyridine-3-carboxamide

Systemtic Name: 2-ethyl-1-[(2-methoxyphenyl)methyl]-6-methyl-4-oxidanylidene-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]pyridine-3-carboxamide Openeye Name: N-(1-benzylpiperidin-1-ium-4-yl)-2-ethyl-1-[(2-methoxyphenyl)methyl]-6-methyl-4-oxo-pyridine-3-carboxamide CAS Name: 2-ethyl-1-[(2-methoxyphenyl)methyl]-6-methyl-4-oxo-N-[1-(phenylmethyl)-4-piperidin-1-iumyl]-3-pyridinecarboxamide IUPAC Name: N-(1-benzylpiperidin-1-ium-4-yl)-2-ethyl-1-[(2-methoxyphenyl)methyl]-6-methyl-4-oxopyridine-3-carboxamide Traditional Name: N-(1-benzylpiperidin-1-ium-4-yl)-2-ethyl-4-keto-6-methyl-1-o-anisyl-nicotinamide Formula: C29H36N3O3+ MolecularWeight: 474.61444

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=O)C=C(N1CC2=CC=CC=C2OC)C)C(=O)NC3CC[NH+](CC3)CC4=CC=CC=C4

Isomeric SMILES

CCC1=C(C(=O)C=C(N1CC2=CC=CC=C2OC)C)C(=O)NC3CC[NH+](CC3)CC4=CC=CC=C4

InChI

InChI=1S/C29H35N3O3/c1-4-25-28(26(33)18-21(2)32(25)20-23-12-8-9-13-27(23)35-3)29(34)30-24-14-16-31(17-15-24)19-22-10-6-5-7-11-22/h5-13,18,24H,4,14-17,19-20H2,1-3H3,(H,30,34)/p+1