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

Systemtic Name: N-(2-chlorophenyl)-2-[4-[2-(2-methoxy-5-methyl-phenyl)ethanoyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: N-(2-chlorophenyl)-2-[4-[2-(2-methoxy-5-methyl-phenyl)acetyl]piperazin-1-ium-1-yl]acetamide CAS Name: N-(2-chlorophenyl)-2-[4-[2-(2-methoxy-5-methylphenyl)-1-oxoethyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(2-chlorophenyl)-2-[4-[2-(2-methoxy-5-methylphenyl)acetyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-(2-chlorophenyl)-2-[4-[2-(2-methoxy-5-methyl-phenyl)acetyl]piperazin-1-ium-1-yl]acetamide Formula: C22H27ClN3O3+ MolecularWeight: 416.92108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)CC(=O)N2CC[NH+](CC2)CC(=O)NC3=CC=CC=C3Cl

Isomeric SMILES

CC1=CC(=C(C=C1)OC)CC(=O)N2CC[NH+](CC2)CC(=O)NC3=CC=CC=C3Cl

InChI

InChI=1S/C22H26ClN3O3/c1-16-7-8-20(29-2)17(13-16)14-22(28)26-11-9-25(10-12-26)15-21(27)24-19-6-4-3-5-18(19)23/h3-8,13H,9-12,14-15H2,1-2H3,(H,24,27)/p+1