1-[4-[4-[(4-dimethylaminophenyl)methyl]piperazin-4-ium-1-yl]phenyl]ethanone

Systemtic Name: 1-[4-[4-[(4-dimethylaminophenyl)methyl]piperazin-4-ium-1-yl]phenyl]ethanone Openeye Name: 1-[4-[4-[(4-dimethylaminophenyl)methyl]piperazin-4-ium-1-yl]phenyl]ethanone CAS Name: 1-[4-[4-[(4-dimethylaminophenyl)methyl]-1-piperazin-4-iumyl]phenyl]ethanone IUPAC Name: 1-[4-[4-[(4-dimethylaminophenyl)methyl]piperazin-4-ium-1-yl]phenyl]ethanone Traditional Name: 1-[4-[4-[4-(dimethylamino)benzyl]piperazin-4-ium-1-yl]phenyl]ethanone Formula: C21H28N3O+ MolecularWeight: 338.46652

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2CC[NH+](CC2)CC3=CC=C(C=C3)N(C)C

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2CC[NH+](CC2)CC3=CC=C(C=C3)N(C)C

InChI

InChI=1S/C21H27N3O/c1-17(25)19-6-10-21(11-7-19)24-14-12-23(13-15-24)16-18-4-8-20(9-5-18)22(2)3/h4-11H,12-16H2,1-3H3/p+1