N-[4-[4-(phenylmethyl)piperazin-4-ium-1-yl]phenyl]pyridine-4-carboxamide

Systemtic Name: N-[4-[4-(phenylmethyl)piperazin-4-ium-1-yl]phenyl]pyridine-4-carboxamide Openeye Name: N-[4-(4-benzylpiperazin-4-ium-1-yl)phenyl]pyridine-4-carboxamide CAS Name: N-[4-[4-(phenylmethyl)-1-piperazin-4-iumyl]phenyl]-4-pyridinecarboxamide IUPAC Name: N-[4-(4-benzylpiperazin-4-ium-1-yl)phenyl]pyridine-4-carboxamide Traditional Name: N-[4-(4-benzylpiperazin-4-ium-1-yl)phenyl]isonicotinamide Formula: C23H25N4O+ MolecularWeight: 373.4708

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=C2)C3=CC=C(C=C3)NC(=O)C4=CC=NC=C4

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=C2)C3=CC=C(C=C3)NC(=O)C4=CC=NC=C4

InChI

InChI=1S/C23H24N4O/c28-23(20-10-12-24-13-11-20)25-21-6-8-22(9-7-21)27-16-14-26(15-17-27)18-19-4-2-1-3-5-19/h1-13H,14-18H2,(H,25,28)/p+1