2-[4-[(4-chlorophenyl)methyl]piperazine-1,4-diium-1-yl]-N-(3-methylphenyl)ethanamide

Systemtic Name: 2-[4-[(4-chlorophenyl)methyl]piperazine-1,4-diium-1-yl]-N-(3-methylphenyl)ethanamide Openeye Name: 2-[4-[(4-chlorophenyl)methyl]piperazine-1,4-diium-1-yl]-N-(m-tolyl)acetamide CAS Name: 2-[4-[(4-chlorophenyl)methyl]-1-piperazine-1,4-diiumyl]-N-(3-methylphenyl)acetamide IUPAC Name: 2-[4-[(4-chlorophenyl)methyl]piperazine-1,4-diium-1-yl]-N-(3-methylphenyl)acetamide Traditional Name: 2-[4-(4-chlorobenzyl)piperazine-1,4-diium-1-yl]-N-(m-tolyl)acetamide Formula: C20H26ClN3O+2 MolecularWeight: 359.89294

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)C[NH+]2CC[NH+](CC2)CC3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)C[NH+]2CC[NH+](CC2)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H24ClN3O/c1-16-3-2-4-19(13-16)22-20(25)15-24-11-9-23(10-12-24)14-17-5-7-18(21)8-6-17/h2-8,13H,9-12,14-15H2,1H3,(H,22,25)/p+2