4-ethyl-1-methoxy-1-(2-methoxyphenyl)-3-(3-phenethyloxyphenyl)piperazin-1-ium dihydrochloride

Systemtic Name: 4-ethyl-1-methoxy-1-(2-methoxyphenyl)-3-(3-phenethyloxyphenyl)piperazin-1-ium dihydrochloride Openeye Name: 4-ethyl-1-methoxy-1-(2-methoxyphenyl)-3-(3-phenethyloxyphenyl)piperazin-1-ium dihydrochloride CAS Name: 4-ethyl-1-methoxy-1-(2-methoxyphenyl)-3-(3-phenethyloxyphenyl)piperazin-1-ium dihydrochloride IUPAC Name: 4-ethyl-1-methoxy-1-(2-methoxyphenyl)-3-(3-phenethyloxyphenyl)piperazin-1-ium dihydrochloride Traditional Name: 4-ethyl-1-methoxy-1-(2-methoxyphenyl)-3-(3-phenethyloxyphenyl)piperazin-1-ium dihydrochloride Formula: C28H37Cl2N2O3+ MolecularWeight: 520.51098

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CC[N+](CC1C2=CC(=CC=C2)OCCC3=CC=CC=C3)(C4=CC=CC=C4OC)OC.Cl.Cl

Isomeric SMILES

CCN1CC[N+](CC1C2=CC(=CC=C2)OCCC3=CC=CC=C3)(C4=CC=CC=C4OC)OC.Cl.Cl

InChI

InChI=1S/C28H35N2O3.2ClH/c1-4-29-18-19-30(32-3,27-15-8-9-16-28(27)31-2)22-26(29)24-13-10-14-25(21-24)33-20-17-23-11-6-5-7-12-23;;/h5-16,21,26H,4,17-20,22H2,1-3H3;2*1H/q+1;;