(E)-3-(4-methylphenyl)-1-(4-methylpiperazin-4-ium-1-yl)prop-2-en-1-one

Systemtic Name: (E)-3-(4-methylphenyl)-1-(4-methylpiperazin-4-ium-1-yl)prop-2-en-1-one Openeye Name: (E)-1-(4-methylpiperazin-4-ium-1-yl)-3-(p-tolyl)prop-2-en-1-one CAS Name: (E)-3-(4-methylphenyl)-1-(4-methyl-1-piperazin-4-iumyl)-2-propen-1-one IUPAC Name: (E)-3-(4-methylphenyl)-1-(4-methylpiperazin-4-ium-1-yl)prop-2-en-1-one Traditional Name: (E)-1-(4-methylpiperazin-4-ium-1-yl)-3-(p-tolyl)prop-2-en-1-one Formula: C15H21N2O+ MolecularWeight: 245.34004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=CC(=O)N2CC[NH+](CC2)C

Isomeric SMILES

CC1=CC=C(C=C1)/C=C/C(=O)N2CC[NH+](CC2)C

InChI

InChI=1S/C15H20N2O/c1-13-3-5-14(6-4-13)7-8-15(18)17-11-9-16(2)10-12-17/h3-8H,9-12H2,1-2H3/p+1/b8-7+