3-(4-methoxyphenyl)-1-(4-phenethylpiperazin-4-ium-1-yl)propan-1-one

Systemtic Name: 3-(4-methoxyphenyl)-1-(4-phenethylpiperazin-4-ium-1-yl)propan-1-one Openeye Name: 3-(4-methoxyphenyl)-1-(4-phenethylpiperazin-4-ium-1-yl)propan-1-one CAS Name: 3-(4-methoxyphenyl)-1-(4-phenethyl-1-piperazin-4-iumyl)-1-propanone IUPAC Name: 3-(4-methoxyphenyl)-1-(4-phenethylpiperazin-4-ium-1-yl)propan-1-one Traditional Name: 3-(4-methoxyphenyl)-1-(4-phenethylpiperazin-4-ium-1-yl)propan-1-one Formula: C22H29N2O2+ MolecularWeight: 353.47786

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCC(=O)N2CC[NH+](CC2)CCC3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)CCC(=O)N2CC[NH+](CC2)CCC3=CC=CC=C3

InChI

InChI=1S/C22H28N2O2/c1-26-21-10-7-20(8-11-21)9-12-22(25)24-17-15-23(16-18-24)14-13-19-5-3-2-4-6-19/h2-8,10-11H,9,12-18H2,1H3/p+1