5-[4-[(Z)-2-(3-methoxyphenyl)ethenyl]pyridin-1-ium-1-yl]pentanoic acid

Systemtic Name: 5-[4-[(Z)-2-(3-methoxyphenyl)ethenyl]pyridin-1-ium-1-yl]pentanoic acid Openeye Name: 5-[4-[(Z)-2-(3-methoxyphenyl)vinyl]pyridin-1-ium-1-yl]pentanoic acid CAS Name: 5-[4-[(Z)-2-(3-methoxyphenyl)ethenyl]-1-pyridin-1-iumyl]pentanoic acid IUPAC Name: 5-[4-[(Z)-2-(3-methoxyphenyl)ethenyl]pyridin-1-ium-1-yl]pentanoic acid Traditional Name: 5-[4-[(Z)-2-(3-methoxyphenyl)vinyl]pyridin-1-ium-1-yl]valeric acid Formula: C19H22NO3+ MolecularWeight: 312.38288

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C=CC2=CC=[N+](C=C2)CCCCC(=O)O

Isomeric SMILES

COC1=CC=CC(=C1)/C=C\C2=CC=[N+](C=C2)CCCCC(=O)O

InChI

InChI=1S/C19H21NO3/c1-23-18-6-4-5-17(15-18)9-8-16-10-13-20(14-11-16)12-3-2-7-19(21)22/h4-6,8-11,13-15H,2-3,7,12H2,1H3/p+1/b9-8-