(E)-3-(1-decylpyridin-1-ium-3-yl)-1-(4-methylthiophen-2-yl)prop-2-en-1-one

Systemtic Name: (E)-3-(1-decylpyridin-1-ium-3-yl)-1-(4-methylthiophen-2-yl)prop-2-en-1-one Openeye Name: (E)-3-(1-decylpyridin-1-ium-3-yl)-1-(4-methyl-2-thienyl)prop-2-en-1-one CAS Name: (E)-3-(1-decyl-3-pyridin-1-iumyl)-1-(4-methyl-2-thiophenyl)-2-propen-1-one IUPAC Name: (E)-3-(1-decylpyridin-1-ium-3-yl)-1-(4-methylthiophen-2-yl)prop-2-en-1-one Traditional Name: (E)-3-(1-decylpyridin-1-ium-3-yl)-1-(4-methyl-2-thienyl)prop-2-en-1-one Formula: C23H32NOS+ MolecularWeight: 370.57128

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC[N+]1=CC=CC(=C1)C=CC(=O)C2=CC(=CS2)C

Isomeric SMILES

CCCCCCCCCC[N+]1=CC=CC(=C1)/C=C/C(=O)C2=CC(=CS2)C

InChI

InChI=1S/C23H32NOS/c1-3-4-5-6-7-8-9-10-15-24-16-11-12-21(18-24)13-14-22(25)23-17-20(2)19-26-23/h11-14,16-19H,3-10,15H2,1-2H3/q+1/b14-13+