1-[(4-nitrophenyl)methyl]-1,10-phenanthrolin-1-ium

Systemtic Name: 1-[(4-nitrophenyl)methyl]-1,10-phenanthrolin-1-ium Openeye Name: 1-[(4-nitrophenyl)methyl]-1,10-phenanthrolin-1-ium CAS Name: 1-[(4-nitrophenyl)methyl]-1,10-phenanthrolin-1-ium IUPAC Name: 1-[(4-nitrophenyl)methyl]-1,10-phenanthrolin-1-ium Traditional Name: 1-(4-nitrobenzyl)-1,10-phenanthrolin-1-ium Formula: C19H14N3O2+ MolecularWeight: 316.33336

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C3=C(C=CC=[N+]3CC4=CC=C(C=C4)[N+](=O)[O-])C=C2)N=C1

Isomeric SMILES

C1=CC2=C(C3=C(C=CC=[N+]3CC4=CC=C(C=C4)[N+](=O)[O-])C=C2)N=C1

InChI

InChI=1S/C19H14N3O2/c23-22(24)17-9-5-14(6-10-17)13-21-12-2-4-16-8-7-15-3-1-11-20-18(15)19(16)21/h1-12H,13H2/q+1