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

Systemtic Name: 5-cyclopropyl-1-phenyl-1,2,4-triazole-3-carboxylic acid Openeye Name: 5-cyclopropyl-1-phenyl-1,2,4-triazole-3-carboxylic acid CAS Name: 5-cyclopropyl-1-phenyl-1,2,4-triazole-3-carboxylic acid IUPAC Name: 5-cyclopropyl-1-phenyl-1,2,4-triazole-3-carboxylic acid Traditional Name: 5-cyclopropyl-1-phenyl-1,2,4-triazole-3-carboxylic acid Formula: C12H11N3O2 MolecularWeight: 229.23464

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NC(=NN2C3=CC=CC=C3)C(=O)O

Isomeric SMILES

C1CC1C2=NC(=NN2C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C12H11N3O2/c16-12(17)10-13-11(8-6-7-8)15(14-10)9-4-2-1-3-5-9/h1-5,8H,6-7H2,(H,16,17)