(E)-1-(4-bromophenyl)-3-(3-oxidanylpyridin-1-ium-1-yl)prop-2-en-1-one

Systemtic Name: (E)-1-(4-bromophenyl)-3-(3-oxidanylpyridin-1-ium-1-yl)prop-2-en-1-one Openeye Name: (E)-1-(4-bromophenyl)-3-(3-hydroxypyridin-1-ium-1-yl)prop-2-en-1-one CAS Name: (E)-1-(4-bromophenyl)-3-(3-hydroxy-1-pyridin-1-iumyl)-2-propen-1-one IUPAC Name: (E)-1-(4-bromophenyl)-3-(3-hydroxypyridin-1-ium-1-yl)prop-2-en-1-one Traditional Name: (E)-1-(4-bromophenyl)-3-(3-hydroxypyridin-1-ium-1-yl)prop-2-en-1-one Formula: C14H11BrNO2+ MolecularWeight: 305.14664

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C[N+](=C1)C=CC(=O)C2=CC=C(C=C2)Br)O

Isomeric SMILES

C1=CC(=C[N+](=C1)/C=C/C(=O)C2=CC=C(C=C2)Br)O

InChI

InChI=1S/C14H10BrNO2/c15-12-5-3-11(4-6-12)14(18)7-9-16-8-1-2-13(17)10-16/h1-10H/p+1/b9-7+