5-ethyl-1-(2-propan-2-ylphenyl)-1,2,4-triazole-3-carboxylic acid

Systemtic Name: 5-ethyl-1-(2-propan-2-ylphenyl)-1,2,4-triazole-3-carboxylic acid Openeye Name: 5-ethyl-1-(2-isopropylphenyl)-1,2,4-triazole-3-carboxylic acid CAS Name: 5-ethyl-1-(2-propan-2-ylphenyl)-1,2,4-triazole-3-carboxylic acid IUPAC Name: 5-ethyl-1-(2-propan-2-ylphenyl)-1,2,4-triazole-3-carboxylic acid Traditional Name: 5-ethyl-1-o-cumenyl-1,2,4-triazole-3-carboxylic acid Formula: C14H17N3O2 MolecularWeight: 259.30368

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=NN1C2=CC=CC=C2C(C)C)C(=O)O

Isomeric SMILES

CCC1=NC(=NN1C2=CC=CC=C2C(C)C)C(=O)O

InChI

InChI=1S/C14H17N3O2/c1-4-12-15-13(14(18)19)16-17(12)11-8-6-5-7-10(11)9(2)3/h5-9H,4H2,1-3H3,(H,18,19)