2-[(E)-2-[1-[(3-nitrophenyl)methyl]pyridin-1-ium-4-yl]ethenyl]phenol

Systemtic Name: 2-[(E)-2-[1-[(3-nitrophenyl)methyl]pyridin-1-ium-4-yl]ethenyl]phenol Openeye Name: 2-[(E)-2-[1-[(3-nitrophenyl)methyl]pyridin-1-ium-4-yl]vinyl]phenol CAS Name: 2-[(E)-2-[1-[(3-nitrophenyl)methyl]-4-pyridin-1-iumyl]ethenyl]phenol IUPAC Name: 2-[(E)-2-[1-[(3-nitrophenyl)methyl]pyridin-1-ium-4-yl]ethenyl]phenol Traditional Name: 2-[(E)-2-[1-(3-nitrobenzyl)pyridin-1-ium-4-yl]vinyl]phenol Formula: C20H17N2O3+ MolecularWeight: 333.36058

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C=CC2=CC=[N+](C=C2)CC3=CC(=CC=C3)[N+](=O)[O-])O

Isomeric SMILES

C1=CC=C(C(=C1)/C=C/C2=CC=[N+](C=C2)CC3=CC(=CC=C3)[N+](=O)[O-])O

InChI

InChI=1S/C20H16N2O3/c23-20-7-2-1-5-18(20)9-8-16-10-12-21(13-11-16)15-17-4-3-6-19(14-17)22(24)25/h1-14H,15H2/p+1