1-[4-[(4-chlorophenyl)methyl]piperazin-4-ium-1-yl]-2-[(2-methoxyphenyl)amino]ethanone

Systemtic Name: 1-[4-[(4-chlorophenyl)methyl]piperazin-4-ium-1-yl]-2-[(2-methoxyphenyl)amino]ethanone Openeye Name: 1-[4-[(4-chlorophenyl)methyl]piperazin-4-ium-1-yl]-2-(2-methoxyanilino)ethanone CAS Name: 1-[4-[(4-chlorophenyl)methyl]-1-piperazin-4-iumyl]-2-(2-methoxyanilino)ethanone IUPAC Name: 1-[4-[(4-chlorophenyl)methyl]piperazin-4-ium-1-yl]-2-(2-methoxyanilino)ethanone Traditional Name: 1-[4-(4-chlorobenzyl)piperazin-4-ium-1-yl]-2-(o-anisidino)ethanone Formula: C20H25ClN3O2+ MolecularWeight: 374.8844

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NCC(=O)N2CC[NH+](CC2)CC3=CC=C(C=C3)Cl

Isomeric SMILES

COC1=CC=CC=C1NCC(=O)N2CC[NH+](CC2)CC3=CC=C(C=C3)Cl

InChI

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