4-[(E)-2-(1-phenethyl-4,6-diphenyl-pyridin-1-ium-2-yl)ethenyl]benzene-1,2-diol

Systemtic Name: 4-[(E)-2-(1-phenethyl-4,6-diphenyl-pyridin-1-ium-2-yl)ethenyl]benzene-1,2-diol Openeye Name: 4-[(E)-2-(1-phenethyl-4,6-diphenyl-pyridin-1-ium-2-yl)vinyl]benzene-1,2-diol CAS Name: 4-[(E)-2-(1-phenethyl-4,6-diphenyl-2-pyridin-1-iumyl)ethenyl]benzene-1,2-diol IUPAC Name: 4-[(E)-2-(1-phenethyl-4,6-diphenylpyridin-1-ium-2-yl)ethenyl]benzene-1,2-diol Traditional Name: 4-[(E)-2-(1-phenethyl-4,6-diphenyl-pyridin-1-ium-2-yl)vinyl]pyrocatechol Formula: C33H28NO2+ MolecularWeight: 470.58092

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC[N+]2=C(C=C(C=C2C=CC3=CC(=C(C=C3)O)O)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)CC[N+]2=C(C=C(C=C2/C=C/C3=CC(=C(C=C3)O)O)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C33H27NO2/c35-32-19-17-26(22-33(32)36)16-18-30-23-29(27-12-6-2-7-13-27)24-31(28-14-8-3-9-15-28)34(30)21-20-25-10-4-1-5-11-25/h1-19,22-24,36H,20-21H2/p+1