5-[4-[(Z)-2-(4-bromophenyl)ethenyl]pyridin-1-ium-1-yl]pentanoate

Systemtic Name: 5-[4-[(Z)-2-(4-bromophenyl)ethenyl]pyridin-1-ium-1-yl]pentanoate Openeye Name: 5-[4-[(Z)-2-(4-bromophenyl)vinyl]pyridin-1-ium-1-yl]pentanoate CAS Name: 5-[4-[(Z)-2-(4-bromophenyl)ethenyl]-1-pyridin-1-iumyl]pentanoate IUPAC Name: 5-[4-[(Z)-2-(4-bromophenyl)ethenyl]pyridin-1-ium-1-yl]pentanoate Traditional Name: 5-[4-[(Z)-2-(4-bromophenyl)vinyl]pyridin-1-ium-1-yl]valerate Formula: C18H18BrNO2 MolecularWeight: 360.24502

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=CC2=CC=[N+](C=C2)CCCCC(=O)[O-])Br

Isomeric SMILES

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

InChI

InChI=1S/C18H18BrNO2/c19-17-8-6-15(7-9-17)4-5-16-10-13-20(14-11-16)12-2-1-3-18(21)22/h4-11,13-14H,1-3,12H2/b5-4-