4-[2-(4-chloranylphenoxy)ethyl]-N-(2-methoxyphenyl)piperazin-4-ium-1-carboxamide

Systemtic Name: 4-[2-(4-chloranylphenoxy)ethyl]-N-(2-methoxyphenyl)piperazin-4-ium-1-carboxamide Openeye Name: 4-[2-(4-chlorophenoxy)ethyl]-N-(2-methoxyphenyl)piperazin-4-ium-1-carboxamide CAS Name: 4-[2-(4-chlorophenoxy)ethyl]-N-(2-methoxyphenyl)-1-piperazin-4-iumcarboxamide IUPAC Name: 4-[2-(4-chlorophenoxy)ethyl]-N-(2-methoxyphenyl)piperazin-4-ium-1-carboxamide Traditional Name: 4-[2-(4-chlorophenoxy)ethyl]-N-(2-methoxyphenyl)piperazin-4-ium-1-carboxamide Formula: C20H25ClN3O3+ MolecularWeight: 390.8838

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC(=O)N2CC[NH+](CC2)CCOC3=CC=C(C=C3)Cl

Isomeric SMILES

COC1=CC=CC=C1NC(=O)N2CC[NH+](CC2)CCOC3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H24ClN3O3/c1-26-19-5-3-2-4-18(19)22-20(25)24-12-10-23(11-13-24)14-15-27-17-8-6-16(21)7-9-17/h2-9H,10-15H2,1H3,(H,22,25)/p+1