2-methyl-6-phenyl-N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]pyridine-3-carboxamide

Systemtic Name: 2-methyl-6-phenyl-N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]pyridine-3-carboxamide Openeye Name: 2-methyl-6-phenyl-N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]pyridine-3-carboxamide CAS Name: 2-methyl-6-phenyl-N-[2-(4-phenyl-1-piperazin-1-iumyl)ethyl]-3-pyridinecarboxamide IUPAC Name: 2-methyl-6-phenyl-N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]pyridine-3-carboxamide Traditional Name: 2-methyl-6-phenyl-N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]nicotinamide Formula: C25H29N4O+ MolecularWeight: 401.52396

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=N1)C2=CC=CC=C2)C(=O)NCC[NH+]3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C=CC(=N1)C2=CC=CC=C2)C(=O)NCC[NH+]3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C25H28N4O/c1-20-23(12-13-24(27-20)21-8-4-2-5-9-21)25(30)26-14-15-28-16-18-29(19-17-28)22-10-6-3-7-11-22/h2-13H,14-19H2,1H3,(H,26,30)/p+1