1-[2-(3-oxidanylidenepiperazin-1-ium-1-yl)ethanoyl]-N-phenyl-piperidine-4-carboxamide

Systemtic Name: 1-[2-(3-oxidanylidenepiperazin-1-ium-1-yl)ethanoyl]-N-phenyl-piperidine-4-carboxamide Openeye Name: 1-[2-(3-oxopiperazin-1-ium-1-yl)acetyl]-N-phenyl-piperidine-4-carboxamide CAS Name: 1-[1-oxo-2-(3-oxo-1-piperazin-1-iumyl)ethyl]-N-phenyl-4-piperidinecarboxamide IUPAC Name: 1-[2-(3-oxopiperazin-1-ium-1-yl)acetyl]-N-phenylpiperidine-4-carboxamide Traditional Name: 1-[2-(3-ketopiperazin-1-ium-1-yl)acetyl]-N-phenyl-isonipecotamide Formula: C18H25N4O3+ MolecularWeight: 345.4161

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC=CC=C2)C(=O)C[NH+]3CCNC(=O)C3

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC=CC=C2)C(=O)C[NH+]3CCNC(=O)C3

InChI

InChI=1S/C18H24N4O3/c23-16-12-21(11-8-19-16)13-17(24)22-9-6-14(7-10-22)18(25)20-15-4-2-1-3-5-15/h1-5,14H,6-13H2,(H,19,23)(H,20,25)/p+1