N-(5-chloranyl-2-methyl-phenyl)-2-[4-[(4-chlorophenyl)methyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(5-chloranyl-2-methyl-phenyl)-2-[4-[(4-chlorophenyl)methyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: N-(5-chloro-2-methyl-phenyl)-2-[4-[(4-chlorophenyl)methyl]piperazin-1-ium-1-yl]acetamide CAS Name: N-(5-chloro-2-methylphenyl)-2-[4-[(4-chlorophenyl)methyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(5-chloro-2-methylphenyl)-2-[4-[(4-chlorophenyl)methyl]piperazin-1-ium-1-yl]acetamide Traditional Name: 2-[4-(4-chlorobenzyl)piperazin-1-ium-1-yl]-N-(5-chloro-2-methyl-phenyl)acetamide Formula: C20H24Cl2N3O+ MolecularWeight: 393.33006

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23Cl2N3O/c1-15-2-5-18(22)12-19(15)23-20(26)14-25-10-8-24(9-11-25)13-16-3-6-17(21)7-4-16/h2-7,12H,8-11,13-14H2,1H3,(H,23,26)/p+1