(E)-2-isoquinolin-2-ium-2-yl-3-(4-nitrophenyl)-3-oxidanylidene-1-phenyl-prop-1-en-1-olate

Systemtic Name: (E)-2-isoquinolin-2-ium-2-yl-3-(4-nitrophenyl)-3-oxidanylidene-1-phenyl-prop-1-en-1-olate Openeye Name: (E)-2-isoquinolin-2-ium-2-yl-3-(4-nitrophenyl)-3-oxo-1-phenyl-prop-1-en-1-olate CAS Name: (E)-2-(2-isoquinolin-2-iumyl)-3-(4-nitrophenyl)-3-oxo-1-phenyl-1-propen-1-olate IUPAC Name: (E)-2-isoquinolin-2-ium-2-yl-3-(4-nitrophenyl)-3-oxo-1-phenylprop-1-en-1-olate Traditional Name: (E)-2-isoquinolin-2-ium-2-yl-3-keto-3-(4-nitrophenyl)-1-phenyl-prop-1-en-1-olate Formula: C24H16N2O4 MolecularWeight: 396.39484

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=C(C(=O)C2=CC=C(C=C2)[N+](=O)[O-])[N+]3=CC4=CC=CC=C4C=C3)[O-]

Isomeric SMILES

C1=CC=C(C=C1)/C(=C(/C(=O)C2=CC=C(C=C2)[N+](=O)[O-])\[N+]3=CC4=CC=CC=C4C=C3)/[O-]

InChI

InChI=1S/C24H16N2O4/c27-23(18-7-2-1-3-8-18)22(24(28)19-10-12-21(13-11-19)26(29)30)25-15-14-17-6-4-5-9-20(17)16-25/h1-16H