(1,4-diphenyl-1,2,4-triazol-4-ium-3-yl)-phenyl-azanide; 2-oxidanylbenzoic acid

Systemtic Name: (1,4-diphenyl-1,2,4-triazol-4-ium-3-yl)-phenyl-azanide; 2-oxidanylbenzoic acid Openeye Name: (1,4-diphenyl-1,2,4-triazol-4-ium-3-yl)-phenyl-azanide; 2-hydroxybenzoic acid CAS Name: (1,4-diphenyl-1,2,4-triazol-4-ium-3-yl)-phenylazanide; 2-hydroxybenzoic acid IUPAC Name: (1,4-diphenyl-1,2,4-triazol-4-ium-3-yl)-phenylazanide; 2-hydroxybenzoic acid Traditional Name: (1,4-diphenyl-1,2,4-triazol-4-ium-3-yl)-phenyl-azanide; salicylic acid Formula: C27H22N4O3 MolecularWeight: 450.48858

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[N-]C2=NN(C=[N+]2C3=CC=CC=C3)C4=CC=CC=C4.C1=CC=C(C(=C1)C(=O)O)O

Isomeric SMILES

C1=CC=C(C=C1)[N-]C2=NN(C=[N+]2C3=CC=CC=C3)C4=CC=CC=C4.C1=CC=C(C(=C1)C(=O)O)O

InChI

InChI=1S/C20H16N4.C7H6O3/c1-4-10-17(11-5-1)21-20-22-24(19-14-8-3-9-15-19)16-23(20)18-12-6-2-7-13-18;8-6-4-2-1-3-5(6)7(9)10/h1-16H;1-4,8H,(H,9,10)