N-[(3-chlorophenyl)methyl]-2-[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-[(3-chlorophenyl)methyl]-2-[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-[(3-chlorophenyl)methyl]-2-[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-[(3-chlorophenyl)methyl]-2-[4-(3-methoxyphenyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-[(3-chlorophenyl)methyl]-2-[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-(3-chlorobenzyl)-2-[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]acetamide Formula: C20H25ClN3O2+ MolecularWeight: 374.8844

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2CC[NH+](CC2)CC(=O)NCC3=CC(=CC=C3)Cl

Isomeric SMILES

COC1=CC=CC(=C1)N2CC[NH+](CC2)CC(=O)NCC3=CC(=CC=C3)Cl

InChI

InChI=1S/C20H24ClN3O2/c1-26-19-7-3-6-18(13-19)24-10-8-23(9-11-24)15-20(25)22-14-16-4-2-5-17(21)12-16/h2-7,12-13H,8-11,14-15H2,1H3,(H,22,25)/p+1