3-[1-[2-(4-iodophenyl)prop-2-enyl]pyridin-1-ium-4-yl]phenolate

Systemtic Name: 3-[1-[2-(4-iodophenyl)prop-2-enyl]pyridin-1-ium-4-yl]phenolate Openeye Name: 3-[1-[2-(4-iodophenyl)allyl]pyridin-1-ium-4-yl]phenolate CAS Name: 3-[1-[2-(4-iodophenyl)prop-2-enyl]-4-pyridin-1-iumyl]phenolate IUPAC Name: 3-[1-[2-(4-iodophenyl)prop-2-enyl]pyridin-1-ium-4-yl]phenolate Traditional Name: 3-[1-[2-(4-iodophenyl)allyl]pyridin-1-ium-4-yl]phenolate Formula: C20H16INO MolecularWeight: 413.25161

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Descriptors Computed from Structure

Canonical SMILES:

C=C(C[N+]1=CC=C(C=C1)C2=CC(=CC=C2)[O-])C3=CC=C(C=C3)I

Isomeric SMILES

C=C(C[N+]1=CC=C(C=C1)C2=CC(=CC=C2)[O-])C3=CC=C(C=C3)I

InChI

InChI=1S/C20H16INO/c1-15(16-5-7-19(21)8-6-16)14-22-11-9-17(10-12-22)18-3-2-4-20(23)13-18/h2-13H,1,14H2