2-(13-aza-1-azoniabicyclo[10.3.0]pentadeca-1(12),14-dien-15-yl)isoindole-1,3-dione

Systemtic Name: 2-(13-aza-1-azoniabicyclo[10.3.0]pentadeca-1(12),14-dien-15-yl)isoindole-1,3-dione Openeye Name: 2-(13-aza-1-azoniabicyclo[10.3.0]pentadeca-1(12),14-dien-15-yl)isoindoline-1,3-dione CAS Name: 2-(13-aza-1-azoniabicyclo[10.3.0]pentadeca-1(12),14-dien-15-yl)isoindole-1,3-dione IUPAC Name: 2-(13-aza-1-azoniabicyclo[10.3.0]pentadeca-1(12),14-dien-15-yl)isoindole-1,3-dione Traditional Name: 2-(13-aza-1-azoniabicyclo[10.3.0]pentadeca-1(12),14-dien-15-yl)isoindoline-1,3-quinone Formula: C21H26N3O2+ MolecularWeight: 352.45004

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCCC[N+]2=C(CCCC1)NC=C2N3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1CCCCC[N+]2=C(CCCC1)NC=C2N3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C21H25N3O2/c25-20-16-11-8-9-12-17(16)21(26)24(20)19-15-22-18-13-7-5-3-1-2-4-6-10-14-23(18)19/h8-9,11-12,15H,1-7,10,13-14H2/p+1