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

Systemtic Name: 1-(2-propan-2-ylphenyl)-5-propyl-1,2,4-triazole-3-carboxylic acid Openeye Name: 1-(2-isopropylphenyl)-5-propyl-1,2,4-triazole-3-carboxylic acid CAS Name: 1-(2-propan-2-ylphenyl)-5-propyl-1,2,4-triazole-3-carboxylic acid IUPAC Name: 1-(2-propan-2-ylphenyl)-5-propyl-1,2,4-triazole-3-carboxylic acid Traditional Name: 1-o-cumenyl-5-propyl-1,2,4-triazole-3-carboxylic acid Formula: C15H19N3O2 MolecularWeight: 273.33026

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=NN1C2=CC=CC=C2C(C)C)C(=O)O

Isomeric SMILES

CCCC1=NC(=NN1C2=CC=CC=C2C(C)C)C(=O)O

InChI

InChI=1S/C15H19N3O2/c1-4-7-13-16-14(15(19)20)17-18(13)12-9-6-5-8-11(12)10(2)3/h5-6,8-10H,4,7H2,1-3H3,(H,19,20)