N-phenyl-4-[[4-(phenylmethyl)piperazin-4-ium-1-yl]methyl]benzamide

Systemtic Name: N-phenyl-4-[[4-(phenylmethyl)piperazin-4-ium-1-yl]methyl]benzamide Openeye Name: 4-[(4-benzylpiperazin-4-ium-1-yl)methyl]-N-phenyl-benzamide CAS Name: N-phenyl-4-[[4-(phenylmethyl)-1-piperazin-4-iumyl]methyl]benzamide IUPAC Name: 4-[(4-benzylpiperazin-4-ium-1-yl)methyl]-N-phenylbenzamide Traditional Name: 4-[(4-benzylpiperazin-4-ium-1-yl)methyl]-N-phenyl-benzamide Formula: C25H28N3O+ MolecularWeight: 386.50932

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=C2)CC3=CC=C(C=C3)C(=O)NC4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=C2)CC3=CC=C(C=C3)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C25H27N3O/c29-25(26-24-9-5-2-6-10-24)23-13-11-22(12-14-23)20-28-17-15-27(16-18-28)19-21-7-3-1-4-8-21/h1-14H,15-20H2,(H,26,29)/p+1