N-(4-butan-2-ylphenyl)-3-phenyl-1,2,3,4-oxatriazol-3-ium-5-amine

Systemtic Name: N-(4-butan-2-ylphenyl)-3-phenyl-1,2,3,4-oxatriazol-3-ium-5-amine Openeye Name: 3-phenyl-N-(4-sec-butylphenyl)oxatriazol-3-ium-5-amine CAS Name: N-(4-butan-2-ylphenyl)-3-phenyl-5-oxatriazol-3-iumamine IUPAC Name: N-(4-butan-2-ylphenyl)-3-phenyloxatriazol-3-ium-5-amine Traditional Name: (3-phenyloxatriazol-3-ium-5-yl)-(4-sec-butylphenyl)amine Formula: C17H19N4O+ MolecularWeight: 295.35896

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)NC2=N[N+](=NO2)C3=CC=CC=C3

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)NC2=N[N+](=NO2)C3=CC=CC=C3

InChI

InChI=1S/C17H19N4O/c1-3-13(2)14-9-11-15(12-10-14)18-17-19-21(20-22-17)16-7-5-4-6-8-16/h4-13H,3H2,1-2H3,(H,18,19,20)/q+1