1-[4-[4-(3-methylbut-2-enyl)piperazin-4-ium-1-yl]phenyl]ethanone

Systemtic Name: 1-[4-[4-(3-methylbut-2-enyl)piperazin-4-ium-1-yl]phenyl]ethanone Openeye Name: 1-[4-[4-(3-methylbut-2-enyl)piperazin-4-ium-1-yl]phenyl]ethanone CAS Name: 1-[4-[4-(3-methylbut-2-enyl)-1-piperazin-4-iumyl]phenyl]ethanone IUPAC Name: 1-[4-[4-(3-methylbut-2-enyl)piperazin-4-ium-1-yl]phenyl]ethanone Traditional Name: 1-[4-[4-(3-methylbut-2-enyl)piperazin-4-ium-1-yl]phenyl]ethanone Formula: C17H25N2O+ MolecularWeight: 273.3932

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC[NH+]1CCN(CC1)C2=CC=C(C=C2)C(=O)C)C

Isomeric SMILES

CC(=CC[NH+]1CCN(CC1)C2=CC=C(C=C2)C(=O)C)C

InChI

InChI=1S/C17H24N2O/c1-14(2)8-9-18-10-12-19(13-11-18)17-6-4-16(5-7-17)15(3)20/h4-8H,9-13H2,1-3H3/p+1