5-methyl-1-(4-propan-2-yloxyphenyl)-1,2,3-triazole-4-carboxylic acid

Systemtic Name: 5-methyl-1-(4-propan-2-yloxyphenyl)-1,2,3-triazole-4-carboxylic acid Openeye Name: 1-(4-isopropoxyphenyl)-5-methyl-triazole-4-carboxylic acid CAS Name: 5-methyl-1-(4-propan-2-yloxyphenyl)-4-triazolecarboxylic acid IUPAC Name: 5-methyl-1-(4-propan-2-yloxyphenyl)triazole-4-carboxylic acid Traditional Name: 1-(4-isopropoxyphenyl)-5-methyl-triazole-4-carboxylic acid Formula: C13H15N3O3 MolecularWeight: 261.2765

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=NN1C2=CC=C(C=C2)OC(C)C)C(=O)O

Isomeric SMILES

CC1=C(N=NN1C2=CC=C(C=C2)OC(C)C)C(=O)O

InChI

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