10-butyl-9-(10-butylacridin-10-ium-9-yl)acridin-10-ium dinitrate

Systemtic Name: 10-butyl-9-(10-butylacridin-10-ium-9-yl)acridin-10-ium dinitrate Openeye Name: 10-butyl-9-(10-butylacridin-10-ium-9-yl)acridin-10-ium dinitrate CAS Name: 10-butyl-9-(10-butyl-9-acridin-10-iumyl)acridin-10-ium dinitrate IUPAC Name: 10-butyl-9-(10-butylacridin-10-ium-9-yl)acridin-10-ium dinitrate Traditional Name: 10-butyl-9-(10-butylacridin-10-ium-9-yl)acridin-10-ium dinitrate Formula: C34H34N4O6 MolecularWeight: 594.65696

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+]1=C2C=CC=CC2=C(C3=CC=CC=C31)C4=C5C=CC=CC5=[N+](C6=CC=CC=C64)CCCC.[N+](=O)([O-])[O-].[N+](=O)([O-])[O-]

Isomeric SMILES

CCCC[N+]1=C2C=CC=CC2=C(C3=CC=CC=C31)C4=C5C=CC=CC5=[N+](C6=CC=CC=C64)CCCC.[N+](=O)([O-])[O-].[N+](=O)([O-])[O-]

InChI

InChI=1S/C34H34N2.2NO3/c1-3-5-23-35-29-19-11-7-15-25(29)33(26-16-8-12-20-30(26)35)34-27-17-9-13-21-31(27)36(24-6-4-2)32-22-14-10-18-28(32)34;2*2-1(3)4/h7-22H,3-6,23-24H2,1-2H3;;/q+2;2*-1