2-(phenylcarbonyl)-N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]benzamide

Systemtic Name: 2-(phenylcarbonyl)-N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]benzamide Openeye Name: 2-benzoyl-N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]benzamide CAS Name: 2-benzoyl-N-[2-(4-phenyl-1-piperazin-1-iumyl)ethyl]benzamide IUPAC Name: 2-benzoyl-N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]benzamide Traditional Name: 2-benzoyl-N-[2-(4-phenylpiperazin-1-ium-1-yl)ethyl]benzamide Formula: C26H28N3O2+ MolecularWeight: 414.51942

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCNC(=O)C2=CC=CC=C2C(=O)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CCNC(=O)C2=CC=CC=C2C(=O)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H27N3O2/c30-25(21-9-3-1-4-10-21)23-13-7-8-14-24(23)26(31)27-15-16-28-17-19-29(20-18-28)22-11-5-2-6-12-22/h1-14H,15-20H2,(H,27,31)/p+1