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

Systemtic Name: 1-[(2-chlorophenyl)methyl]-6-oxidanylidene-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]pyridine-3-carboxamide Openeye Name: N-(1-benzylpiperidin-1-ium-4-yl)-1-[(2-chlorophenyl)methyl]-6-oxo-pyridine-3-carboxamide CAS Name: 1-[(2-chlorophenyl)methyl]-6-oxo-N-[1-(phenylmethyl)-4-piperidin-1-iumyl]-3-pyridinecarboxamide IUPAC Name: N-(1-benzylpiperidin-1-ium-4-yl)-1-[(2-chlorophenyl)methyl]-6-oxopyridine-3-carboxamide Traditional Name: N-(1-benzylpiperidin-1-ium-4-yl)-1-(2-chlorobenzyl)-6-keto-nicotinamide Formula: C25H27ClN3O2+ MolecularWeight: 436.95378

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NC(=O)C2=CN(C(=O)C=C2)CC3=CC=CC=C3Cl)CC4=CC=CC=C4

Isomeric SMILES

C1C[NH+](CCC1NC(=O)C2=CN(C(=O)C=C2)CC3=CC=CC=C3Cl)CC4=CC=CC=C4

InChI

InChI=1S/C25H26ClN3O2/c26-23-9-5-4-8-20(23)17-29-18-21(10-11-24(29)30)25(31)27-22-12-14-28(15-13-22)16-19-6-2-1-3-7-19/h1-11,18,22H,12-17H2,(H,27,31)/p+1