2-[(E)-2-[1-(6-azanylhexyl)pyridin-1-ium-2-yl]ethenyl]-5-methoxy-phenol

Systemtic Name: 2-[(E)-2-[1-(6-azanylhexyl)pyridin-1-ium-2-yl]ethenyl]-5-methoxy-phenol Openeye Name: 2-[(E)-2-[1-(6-aminohexyl)pyridin-1-ium-2-yl]vinyl]-5-methoxy-phenol CAS Name: 2-[(E)-2-[1-(6-aminohexyl)-2-pyridin-1-iumyl]ethenyl]-5-methoxyphenol IUPAC Name: 2-[(E)-2-[1-(6-aminohexyl)pyridin-1-ium-2-yl]ethenyl]-5-methoxyphenol Traditional Name: 2-[(E)-2-[1-(6-aminohexyl)pyridin-1-ium-2-yl]vinyl]-5-methoxy-phenol Formula: C20H27N2O2+ MolecularWeight: 327.44058

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C=CC2=CC=CC=[N+]2CCCCCCN)O

Isomeric SMILES

COC1=CC(=C(C=C1)/C=C/C2=CC=CC=[N+]2CCCCCCN)O

InChI

InChI=1S/C20H26N2O2/c1-24-19-12-10-17(20(23)16-19)9-11-18-8-4-7-15-22(18)14-6-3-2-5-13-21/h4,7-12,15-16H,2-3,5-6,13-14,21H2,1H3/p+1