N-phenyl-4-[(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)methyl]benzamide

Systemtic Name: N-phenyl-4-[(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)methyl]benzamide Openeye Name: N-phenyl-4-[(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)methyl]benzamide CAS Name: N-phenyl-4-[[4-(2-pyridin-1-iumyl)-1-piperazin-1-iumyl]methyl]benzamide IUPAC Name: N-phenyl-4-[(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)methyl]benzamide Traditional Name: N-phenyl-4-[(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)methyl]benzamide Formula: C23H26N4O+2 MolecularWeight: 374.47874

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3)C4=CC=CC=[NH+]4

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3)C4=CC=CC=[NH+]4

InChI

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