4-[(4-phenylpiperazin-1-ium-1-yl)methyl]-N-pyridin-3-yl-benzamide

Systemtic Name: 4-[(4-phenylpiperazin-1-ium-1-yl)methyl]-N-pyridin-3-yl-benzamide Openeye Name: 4-[(4-phenylpiperazin-1-ium-1-yl)methyl]-N-(3-pyridyl)benzamide CAS Name: 4-[(4-phenyl-1-piperazin-1-iumyl)methyl]-N-(3-pyridinyl)benzamide IUPAC Name: 4-[(4-phenylpiperazin-1-ium-1-yl)methyl]-N-pyridin-3-ylbenzamide Traditional Name: 4-[(4-phenylpiperazin-1-ium-1-yl)methyl]-N-(3-pyridyl)benzamide Formula: C23H25N4O+ MolecularWeight: 373.4708

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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