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

Systemtic Name: (E)-3-(1-decylpyridin-1-ium-4-yl)-1-(3-hydroxyphenyl)prop-2-en-1-one bromide Openeye Name: (E)-3-(1-decylpyridin-1-ium-4-yl)-1-(3-hydroxyphenyl)prop-2-en-1-one bromide CAS Name: (E)-3-(1-decyl-4-pyridin-1-iumyl)-1-(3-hydroxyphenyl)-2-propen-1-one bromide IUPAC Name: (E)-3-(1-decylpyridin-1-ium-4-yl)-1-(3-hydroxyphenyl)prop-2-en-1-one bromide Traditional Name: (E)-3-(1-decylpyridin-1-ium-4-yl)-1-(3-hydroxyphenyl)prop-2-en-1-one bromide Formula: C24H32BrNO2 MolecularWeight: 446.42038

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC[N+]1=CC=C(C=C1)C=CC(=O)C2=CC(=CC=C2)O.[Br-]

Isomeric SMILES

CCCCCCCCCC[N+]1=CC=C(C=C1)/C=C/C(=O)C2=CC(=CC=C2)O.[Br-]

InChI

InChI=1S/C24H31NO2.BrH/c1-2-3-4-5-6-7-8-9-17-25-18-15-21(16-19-25)13-14-24(27)22-11-10-12-23(26)20-22;/h10-16,18-20H,2-9,17H2,1H3;1H/b14-13+;