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

Systemtic Name: 4-[3-(5-azanyl-3-butyl-1,2,3-oxadiazol-3-ium-4-yl)phenyl]-3-butyl-1,2,3-oxadiazol-3-ium-5-amine Openeye Name: 4-[3-(5-amino-3-butyl-oxadiazol-3-ium-4-yl)phenyl]-3-butyl-oxadiazol-3-ium-5-amine CAS Name: 4-[3-(5-amino-3-butyl-4-oxadiazol-3-iumyl)phenyl]-3-butyl-5-oxadiazol-3-iumamine IUPAC Name: 4-[3-(5-amino-3-butyloxadiazol-3-ium-4-yl)phenyl]-3-butyloxadiazol-3-ium-5-amine Traditional Name: [4-[3-(5-amino-3-butyl-oxadiazol-3-ium-4-yl)phenyl]-3-butyl-oxadiazol-3-ium-5-yl]amine Formula: C18H26N6O2+2 MolecularWeight: 358.43804

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H26N6O2/c1-3-5-10-23-15(17(19)25-21-23)13-8-7-9-14(12-13)16-18(20)26-22-24(16)11-6-4-2/h7-9,12H,3-6,10-11,19-20H2,1-2H3/q+2