1-[2-(1,3-dioxolan-2-yl)ethyl]-4-[(E)-2-phenylethenyl]pyridin-1-ium bromide

Systemtic Name: 1-[2-(1,3-dioxolan-2-yl)ethyl]-4-[(E)-2-phenylethenyl]pyridin-1-ium bromide Openeye Name: 1-[2-(1,3-dioxolan-2-yl)ethyl]-4-[(E)-styryl]pyridin-1-ium bromide CAS Name: 1-[2-(1,3-dioxolan-2-yl)ethyl]-4-[(E)-2-phenylethenyl]pyridin-1-ium bromide IUPAC Name: 1-[2-(1,3-dioxolan-2-yl)ethyl]-4-[(E)-2-phenylethenyl]pyridin-1-ium bromide Traditional Name: 1-[2-(1,3-dioxolan-2-yl)ethyl]-4-[(E)-styryl]pyridin-1-ium bromide Formula: C18H20BrNO2 MolecularWeight: 362.2609

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(O1)CC[N+]2=CC=C(C=C2)C=CC3=CC=CC=C3.[Br-]

Isomeric SMILES

C1COC(O1)CC[N+]2=CC=C(C=C2)/C=C/C3=CC=CC=C3.[Br-]

InChI

InChI=1S/C18H20NO2.BrH/c1-2-4-16(5-3-1)6-7-17-8-11-19(12-9-17)13-10-18-20-14-15-21-18;/h1-9,11-12,18H,10,13-15H2;1H/q+1;/p-1/b7-6+;