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

Systemtic Name: 6-(2,4-dinitrophenyl)-6H-pyrido[2,1-a]isoindol-5-ium perchlorate Openeye Name: 6-(2,4-dinitrophenyl)-6H-pyrido[2,1-a]isoindol-5-ium perchlorate CAS Name: 6-(2,4-dinitrophenyl)-6H-pyrido[2,1-a]isoindol-5-ium perchlorate IUPAC Name: 6-(2,4-dinitrophenyl)-6H-pyrido[2,1-a]isoindol-5-ium perchlorate Traditional Name: 6-(2,4-dinitrophenyl)-6H-pyrid[2,1-a]isoindol-5-ium perchlorate Formula: C18H12ClN3O8 MolecularWeight: 433.75618

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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-].[O-]Cl(=O)(=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-].[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C18H12N3O4.ClHO4/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;2-1(3,4)5/h1-11,18H;(H,2,3,4,5)/q+1;/p-1