5-(3-methoxyphenyl)-3,8-dinitro-benzo[c]cinnolin-5-ium

Systemtic Name: 5-(3-methoxyphenyl)-3,8-dinitro-benzo[c]cinnolin-5-ium Openeye Name: 5-(3-methoxyphenyl)-3,8-dinitro-benzo[c]cinnolin-5-ium CAS Name: 5-(3-methoxyphenyl)-3,8-dinitrobenzo[c]cinnolin-5-ium IUPAC Name: 5-(3-methoxyphenyl)-3,8-dinitrobenzo[c]cinnolin-5-ium Traditional Name: 5-(3-methoxyphenyl)-3,8-dinitro-benzo[c]cinnolin-5-ium Formula: C19H13N4O5+ MolecularWeight: 377.33032

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)[N+]2=C3C=C(C=CC3=C4C=CC(=CC4=N2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC(=C1)[N+]2=C3C=C(C=CC3=C4C=CC(=CC4=N2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C19H13N4O5/c1-28-15-4-2-3-12(9-15)21-19-11-14(23(26)27)6-8-17(19)16-7-5-13(22(24)25)10-18(16)20-21/h2-11H,1H3/q+1