N,N'-bis(3-azanyl-1H-isoindol-2-ium-2-yl)hexanediamide

Systemtic Name: N,N'-bis(3-azanyl-1H-isoindol-2-ium-2-yl)hexanediamide Openeye Name: N,N'-bis(3-amino-1H-isoindol-2-ium-2-yl)hexanediamide CAS Name: N,N'-bis(3-amino-1H-isoindol-2-ium-2-yl)hexanediamide IUPAC Name: N,N'-bis(3-amino-1H-isoindol-2-ium-2-yl)hexanediamide Traditional Name: N,N'-bis(3-amino-1H-isoindol-2-ium-2-yl)adipamide Formula: C22H26N6O2+2 MolecularWeight: 406.48084

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C(=[N+]1NC(=O)CCCCC(=O)N[N+]3=C(C4=CC=CC=C4C3)N)N

Isomeric SMILES

C1C2=CC=CC=C2C(=[N+]1NC(=O)CCCCC(=O)N[N+]3=C(C4=CC=CC=C4C3)N)N

InChI

InChI=1S/C22H24N6O2/c23-21-17-9-3-1-7-15(17)13-27(21)25-19(29)11-5-6-12-20(30)26-28-14-16-8-2-4-10-18(16)22(28)24/h1-4,7-10,23-24H,5-6,11-14H2,(H2,25,26,29,30)/p+2