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

Systemtic Name: (E)-1-(4-methylpiperazin-4-ium-1-yl)-3-(4-propan-2-ylphenyl)prop-2-en-1-one Openeye Name: (E)-3-(4-isopropylphenyl)-1-(4-methylpiperazin-4-ium-1-yl)prop-2-en-1-one CAS Name: (E)-1-(4-methyl-1-piperazin-4-iumyl)-3-(4-propan-2-ylphenyl)-2-propen-1-one IUPAC Name: (E)-1-(4-methylpiperazin-4-ium-1-yl)-3-(4-propan-2-ylphenyl)prop-2-en-1-one Traditional Name: (E)-1-(4-methylpiperazin-4-ium-1-yl)-3-p-cumenyl-prop-2-en-1-one Formula: C17H25N2O+ MolecularWeight: 273.3932

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H24N2O/c1-14(2)16-7-4-15(5-8-16)6-9-17(20)19-12-10-18(3)11-13-19/h4-9,14H,10-13H2,1-3H3/p+1/b9-6+