1-(2-methylphenyl)-5-propan-2-yl-1,2,4-triazole-3-carboxylic acid

Systemtic Name: 1-(2-methylphenyl)-5-propan-2-yl-1,2,4-triazole-3-carboxylic acid Openeye Name: 5-isopropyl-1-(o-tolyl)-1,2,4-triazole-3-carboxylic acid CAS Name: 1-(2-methylphenyl)-5-propan-2-yl-1,2,4-triazole-3-carboxylic acid IUPAC Name: 1-(2-methylphenyl)-5-propan-2-yl-1,2,4-triazole-3-carboxylic acid Traditional Name: 5-isopropyl-1-(o-tolyl)-1,2,4-triazole-3-carboxylic acid Formula: C13H15N3O2 MolecularWeight: 245.2771

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=NC(=N2)C(=O)O)C(C)C

Isomeric SMILES

CC1=CC=CC=C1N2C(=NC(=N2)C(=O)O)C(C)C

InChI

InChI=1S/C13H15N3O2/c1-8(2)12-14-11(13(17)18)15-16(12)10-7-5-4-6-9(10)3/h4-8H,1-3H3,(H,17,18)