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

Systemtic Name: 1-(3-methoxyphenyl)-5-propan-2-yl-1,2,4-triazole-3-carboxylic acid Openeye Name: 5-isopropyl-1-(3-methoxyphenyl)-1,2,4-triazole-3-carboxylic acid CAS Name: 1-(3-methoxyphenyl)-5-propan-2-yl-1,2,4-triazole-3-carboxylic acid IUPAC Name: 1-(3-methoxyphenyl)-5-propan-2-yl-1,2,4-triazole-3-carboxylic acid Traditional Name: 5-isopropyl-1-(3-methoxyphenyl)-1,2,4-triazole-3-carboxylic acid Formula: C13H15N3O3 MolecularWeight: 261.2765

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC(=NN1C2=CC(=CC=C2)OC)C(=O)O

Isomeric SMILES

CC(C)C1=NC(=NN1C2=CC(=CC=C2)OC)C(=O)O

InChI

InChI=1S/C13H15N3O3/c1-8(2)12-14-11(13(17)18)15-16(12)9-5-4-6-10(7-9)19-3/h4-8H,1-3H3,(H,17,18)