4-[3-(5-azanyl-3-hexyl-1,2,3-oxadiazol-3-ium-4-yl)phenyl]-3-hexyl-1,2,3-oxadiazol-3-ium-5-amine

Systemtic Name: 4-[3-(5-azanyl-3-hexyl-1,2,3-oxadiazol-3-ium-4-yl)phenyl]-3-hexyl-1,2,3-oxadiazol-3-ium-5-amine Openeye Name: 4-[3-(5-amino-3-hexyl-oxadiazol-3-ium-4-yl)phenyl]-3-hexyl-oxadiazol-3-ium-5-amine CAS Name: 4-[3-(5-amino-3-hexyl-4-oxadiazol-3-iumyl)phenyl]-3-hexyl-5-oxadiazol-3-iumamine IUPAC Name: 4-[3-(5-amino-3-hexyloxadiazol-3-ium-4-yl)phenyl]-3-hexyloxadiazol-3-ium-5-amine Traditional Name: [4-[3-(5-amino-3-hexyl-oxadiazol-3-ium-4-yl)phenyl]-3-hexyl-oxadiazol-3-ium-5-yl]amine Formula: C22H34N6O2+2 MolecularWeight: 414.54436

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC[N+]1=NOC(=C1C2=CC(=CC=C2)C3=C(ON=[N+]3CCCCCC)N)N

Isomeric SMILES

CCCCCC[N+]1=NOC(=C1C2=CC(=CC=C2)C3=C(ON=[N+]3CCCCCC)N)N

InChI

InChI=1S/C22H34N6O2/c1-3-5-7-9-14-27-19(21(23)29-25-27)17-12-11-13-18(16-17)20-22(24)30-26-28(20)15-10-8-6-4-2/h11-13,16H,3-10,14-15,23-24H2,1-2H3/q+2