N-[(2-chlorophenyl)methyl]-3-[1-(1-oxidanidylpyridin-1-ium-3-yl)carbonylpiperidin-3-yl]propanamide

Systemtic Name: N-[(2-chlorophenyl)methyl]-3-[1-(1-oxidanidylpyridin-1-ium-3-yl)carbonylpiperidin-3-yl]propanamide Openeye Name: N-[(2-chlorophenyl)methyl]-3-[1-(1-oxidopyridin-1-ium-3-carbonyl)-3-piperidyl]propanamide CAS Name: N-[(2-chlorophenyl)methyl]-3-[1-[(1-oxido-3-pyridin-1-iumyl)-oxomethyl]-3-piperidinyl]propanamide IUPAC Name: N-[(2-chlorophenyl)methyl]-3-[1-(1-oxidopyridin-1-ium-3-carbonyl)piperidin-3-yl]propanamide Traditional Name: N-(2-chlorobenzyl)-3-[1-(1-oxidopyridin-1-ium-3-carbonyl)-3-piperidyl]propionamide Formula: C21H24ClN3O3 MolecularWeight: 401.88656

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=C[N+](=CC=C2)[O-])CCC(=O)NCC3=CC=CC=C3Cl

Isomeric SMILES

C1CC(CN(C1)C(=O)C2=C[N+](=CC=C2)[O-])CCC(=O)NCC3=CC=CC=C3Cl

InChI

InChI=1S/C21H24ClN3O3/c22-19-8-2-1-6-17(19)13-23-20(26)10-9-16-5-3-11-24(14-16)21(27)18-7-4-12-25(28)15-18/h1-2,4,6-8,12,15-16H,3,5,9-11,13-14H2,(H,23,26)