3-phenyl-1H-1,2,4-triazole-5-carboxylic acid

Systemtic Name: 3-phenyl-1H-1,2,4-triazole-5-carboxylic acid Openeye Name: 3-phenyl-1H-1,2,4-triazole-5-carboxylic acid CAS Name: 3-phenyl-1H-1,2,4-triazole-5-carboxylic acid IUPAC Name: 3-phenyl-1H-1,2,4-triazole-5-carboxylic acid Traditional Name: 3-phenyl-1H-1,2,4-triazole-5-carboxylic acid Formula: C9H7N3O2 MolecularWeight: 189.17078

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NNC(=N2)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=NNC(=N2)C(=O)O

InChI

InChI=1S/C9H7N3O2/c13-9(14)8-10-7(11-12-8)6-4-2-1-3-5-6/h1-5H,(H,13,14)(H,10,11,12)