(Z)-2-[2,5-dimethyl-4-(4-nitrophenyl)pyridin-1-ium-1-yl]-1-phenyl-ethenolate

Systemtic Name: (Z)-2-[2,5-dimethyl-4-(4-nitrophenyl)pyridin-1-ium-1-yl]-1-phenyl-ethenolate Openeye Name: (Z)-2-[2,5-dimethyl-4-(4-nitrophenyl)pyridin-1-ium-1-yl]-1-phenyl-ethenolate CAS Name: (Z)-2-[2,5-dimethyl-4-(4-nitrophenyl)-1-pyridin-1-iumyl]-1-phenylethenolate IUPAC Name: (Z)-2-[2,5-dimethyl-4-(4-nitrophenyl)pyridin-1-ium-1-yl]-1-phenylethenolate Traditional Name: (Z)-2-[2,5-dimethyl-4-(4-nitrophenyl)pyridin-1-ium-1-yl]-1-phenyl-ethenolate Formula: C21H18N2O3 MolecularWeight: 346.37922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C=C(C(=C1)C2=CC=C(C=C2)[N+](=O)[O-])C)C=C(C3=CC=CC=C3)[O-]

Isomeric SMILES

CC1=[N+](C=C(C(=C1)C2=CC=C(C=C2)[N+](=O)[O-])C)/C=C(/C3=CC=CC=C3)\[O-]

InChI

InChI=1S/C21H18N2O3/c1-15-13-22(14-21(24)18-6-4-3-5-7-18)16(2)12-20(15)17-8-10-19(11-9-17)23(25)26/h3-14H,1-2H3/b21-14-