4-[4-(1,2,4-triazol-1-yl)phenyl]benzoic acid

Systemtic Name: 4-[4-(1,2,4-triazol-1-yl)phenyl]benzoic acid Openeye Name: 4-[4-(1,2,4-triazol-1-yl)phenyl]benzoic acid CAS Name: 4-[4-(1,2,4-triazol-1-yl)phenyl]benzoic acid IUPAC Name: 4-[4-(1,2,4-triazol-1-yl)phenyl]benzoic acid Traditional Name: 4-[4-(1,2,4-triazol-1-yl)phenyl]benzoic acid Formula: C15H11N3O2 MolecularWeight: 265.26674

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC=C(C=C2)N3C=NC=N3)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1C2=CC=C(C=C2)N3C=NC=N3)C(=O)O

InChI

InChI=1S/C15H11N3O2/c19-15(20)13-3-1-11(2-4-13)12-5-7-14(8-6-12)18-10-16-9-17-18/h1-10H,(H,19,20)