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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=NN1C2=CC(=CC=C2)OC)C(=O)O

Isomeric SMILES

CCCC1=NC(=NN1C2=CC(=CC=C2)OC)C(=O)O

InChI

InChI=1S/C13H15N3O3/c1-3-5-11-14-12(13(17)18)15-16(11)9-6-4-7-10(8-9)19-2/h4,6-8H,3,5H2,1-2H3,(H,17,18)