4-phenyl-1-(4-prop-2-enylpiperazin-4-ium-1-yl)butan-1-one

Systemtic Name: 4-phenyl-1-(4-prop-2-enylpiperazin-4-ium-1-yl)butan-1-one Openeye Name: 1-(4-allylpiperazin-4-ium-1-yl)-4-phenyl-butan-1-one CAS Name: 4-phenyl-1-(4-prop-2-enyl-1-piperazin-4-iumyl)-1-butanone IUPAC Name: 4-phenyl-1-(4-prop-2-enylpiperazin-4-ium-1-yl)butan-1-one Traditional Name: 1-(4-allylpiperazin-4-ium-1-yl)-4-phenyl-butan-1-one Formula: C17H25N2O+ MolecularWeight: 273.3932

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Descriptors Computed from Structure

Canonical SMILES:

C=CC[NH+]1CCN(CC1)C(=O)CCCC2=CC=CC=C2

Isomeric SMILES

C=CC[NH+]1CCN(CC1)C(=O)CCCC2=CC=CC=C2

InChI

InChI=1S/C17H24N2O/c1-2-11-18-12-14-19(15-13-18)17(20)10-6-9-16-7-4-3-5-8-16/h2-5,7-8H,1,6,9-15H2/p+1