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

Systemtic Name: N-(3-chlorophenyl)-4-[(4-phenylpiperazin-1-ium-1-yl)methyl]benzamide Openeye Name: N-(3-chlorophenyl)-4-[(4-phenylpiperazin-1-ium-1-yl)methyl]benzamide CAS Name: N-(3-chlorophenyl)-4-[(4-phenyl-1-piperazin-1-iumyl)methyl]benzamide IUPAC Name: N-(3-chlorophenyl)-4-[(4-phenylpiperazin-1-ium-1-yl)methyl]benzamide Traditional Name: N-(3-chlorophenyl)-4-[(4-phenylpiperazin-1-ium-1-yl)methyl]benzamide Formula: C24H25ClN3O+ MolecularWeight: 406.9278

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H24ClN3O/c25-21-5-4-6-22(17-21)26-24(29)20-11-9-19(10-12-20)18-27-13-15-28(16-14-27)23-7-2-1-3-8-23/h1-12,17H,13-16,18H2,(H,26,29)/p+1