1-methyl-3-phenyl-5-(phenylcarbamoyl)-1,2,3-triazol-1-ium-4-olate

Systemtic Name: 1-methyl-3-phenyl-5-(phenylcarbamoyl)-1,2,3-triazol-1-ium-4-olate Openeye Name: 1-methyl-3-phenyl-5-(phenylcarbamoyl)triazol-1-ium-4-olate CAS Name: 5-[anilino(oxo)methyl]-1-methyl-3-phenyl-4-triazol-1-iumolate IUPAC Name: 1-methyl-3-phenyl-5-(phenylcarbamoyl)triazol-1-ium-4-olate Traditional Name: 1-methyl-3-phenyl-5-(phenylcarbamoyl)triazol-1-ium-4-olate Formula: C16H14N4O2 MolecularWeight: 294.30796

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=NN(C(=C1C(=O)NC2=CC=CC=C2)[O-])C3=CC=CC=C3

Isomeric SMILES

C[N+]1=NN(C(=C1C(=O)NC2=CC=CC=C2)[O-])C3=CC=CC=C3

InChI

InChI=1S/C16H14N4O2/c1-19-14(15(21)17-12-8-4-2-5-9-12)16(22)20(18-19)13-10-6-3-7-11-13/h2-11H,1H3,(H-,17,18,21,22)