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

Systemtic Name: N-[(4-chlorophenyl)methyl]-4-[(4-phenylpiperazin-1-ium-1-yl)methyl]benzamide Openeye Name: N-[(4-chlorophenyl)methyl]-4-[(4-phenylpiperazin-1-ium-1-yl)methyl]benzamide CAS Name: N-[(4-chlorophenyl)methyl]-4-[(4-phenyl-1-piperazin-1-iumyl)methyl]benzamide IUPAC Name: N-[(4-chlorophenyl)methyl]-4-[(4-phenylpiperazin-1-ium-1-yl)methyl]benzamide Traditional Name: N-(4-chlorobenzyl)-4-[(4-phenylpiperazin-1-ium-1-yl)methyl]benzamide Formula: C25H27ClN3O+ MolecularWeight: 420.95438

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=C(C=C2)C(=O)NCC3=CC=C(C=C3)Cl)C4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=C(C=C2)C(=O)NCC3=CC=C(C=C3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C25H26ClN3O/c26-23-12-8-20(9-13-23)18-27-25(30)22-10-6-21(7-11-22)19-28-14-16-29(17-15-28)24-4-2-1-3-5-24/h1-13H,14-19H2,(H,27,30)/p+1