1-[4-[(4-methoxyphenyl)methyl]-4-methyl-piperazin-4-ium-1-yl]octan-1-one

Systemtic Name: 1-[4-[(4-methoxyphenyl)methyl]-4-methyl-piperazin-4-ium-1-yl]octan-1-one Openeye Name: 1-[4-[(4-methoxyphenyl)methyl]-4-methyl-piperazin-4-ium-1-yl]octan-1-one CAS Name: 1-[4-[(4-methoxyphenyl)methyl]-4-methyl-1-piperazin-4-iumyl]-1-octanone IUPAC Name: 1-[4-[(4-methoxyphenyl)methyl]-4-methylpiperazin-4-ium-1-yl]octan-1-one Traditional Name: 1-(4-methyl-4-p-anisyl-piperazin-4-ium-1-yl)octan-1-one Formula: C21H35N2O2+ MolecularWeight: 347.5148

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)N1CC[N+](CC1)(C)CC2=CC=C(C=C2)OC

Isomeric SMILES

CCCCCCCC(=O)N1CC[N+](CC1)(C)CC2=CC=C(C=C2)OC

InChI

InChI=1S/C21H35N2O2/c1-4-5-6-7-8-9-21(24)22-14-16-23(2,17-15-22)18-19-10-12-20(25-3)13-11-19/h10-13H,4-9,14-18H2,1-3H3/q+1