N-[1-[(4-chlorophenyl)methyl]piperidin-4-yl]-1-oxidanidyl-pyridin-1-ium-3-carboxamide

Systemtic Name: N-[1-[(4-chlorophenyl)methyl]piperidin-4-yl]-1-oxidanidyl-pyridin-1-ium-3-carboxamide Openeye Name: N-[1-[(4-chlorophenyl)methyl]-4-piperidyl]-1-oxido-pyridin-1-ium-3-carboxamide CAS Name: N-[1-[(4-chlorophenyl)methyl]-4-piperidinyl]-1-oxido-3-pyridin-1-iumcarboxamide IUPAC Name: N-[1-[(4-chlorophenyl)methyl]piperidin-4-yl]-1-oxidopyridin-1-ium-3-carboxamide Traditional Name: N-[1-(4-chlorobenzyl)-4-piperidyl]-1-oxido-pyridin-1-ium-3-carboxamide Formula: C18H20ClN3O2 MolecularWeight: 345.8233

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)C2=C[N+](=CC=C2)[O-])CC3=CC=C(C=C3)Cl

Isomeric SMILES

C1CN(CCC1NC(=O)C2=C[N+](=CC=C2)[O-])CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H20ClN3O2/c19-16-5-3-14(4-6-16)12-21-10-7-17(8-11-21)20-18(23)15-2-1-9-22(24)13-15/h1-6,9,13,17H,7-8,10-12H2,(H,20,23)