(Z)-N-[1-(4-nitrophenyl)-3,5-diphenyl-1,2,4-triazol-1-ium-4-yl]benzenecarboximidate

Systemtic Name: (Z)-N-[1-(4-nitrophenyl)-3,5-diphenyl-1,2,4-triazol-1-ium-4-yl]benzenecarboximidate Openeye Name: (Z)-N-[1-(4-nitrophenyl)-3,5-diphenyl-1,2,4-triazol-1-ium-4-yl]benzenecarboximidate CAS Name: (Z)-N-[1-(4-nitrophenyl)-3,5-diphenyl-1,2,4-triazol-1-ium-4-yl]benzenecarboximidate IUPAC Name: (Z)-N-[1-(4-nitrophenyl)-3,5-diphenyl-1,2,4-triazol-1-ium-4-yl]benzenecarboximidate Traditional Name: (Z)-N-[1-(4-nitrophenyl)-3,5-diphenyl-1,2,4-triazol-1-ium-4-yl]benzenecarboximidate Formula: C27H19N5O3 MolecularWeight: 461.47146

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=N[N+](=C(N2N=C(C3=CC=CC=C3)[O-])C4=CC=CC=C4)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=N[N+](=C(N2/N=C(/C3=CC=CC=C3)\[O-])C4=CC=CC=C4)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C27H19N5O3/c33-26(21-12-6-2-7-13-21)29-31-25(20-10-4-1-5-11-20)28-30(27(31)22-14-8-3-9-15-22)23-16-18-24(19-17-23)32(34)35/h1-19H