6-(2,4-dinitrophenyl)-6H-pyrido[2,1-a]isoindol-5-ium

Systemtic Name: 6-(2,4-dinitrophenyl)-6H-pyrido[2,1-a]isoindol-5-ium Openeye Name: 6-(2,4-dinitrophenyl)-6H-pyrido[2,1-a]isoindol-5-ium CAS Name: 6-(2,4-dinitrophenyl)-6H-pyrido[2,1-a]isoindol-5-ium IUPAC Name: 6-(2,4-dinitrophenyl)-6H-pyrido[2,1-a]isoindol-5-ium Traditional Name: 6-(2,4-dinitrophenyl)-6H-pyrid[2,1-a]isoindol-5-ium Formula: C18H12N3O4+ MolecularWeight: 334.30558

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C([N+]3=CC=CC=C23)C4=C(C=C(C=C4)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C([N+]3=CC=CC=C23)C4=C(C=C(C=C4)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C18H12N3O4/c22-20(23)12-8-9-15(17(11-12)21(24)25)18-14-6-2-1-5-13(14)16-7-3-4-10-19(16)18/h1-11,18H/q+1