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

Systemtic Name: 1-(2,5-dimethylphenyl)-5-propyl-1,2,3-triazole-4-carboxylic acid Openeye Name: 1-(2,5-dimethylphenyl)-5-propyl-triazole-4-carboxylic acid CAS Name: 1-(2,5-dimethylphenyl)-5-propyl-4-triazolecarboxylic acid IUPAC Name: 1-(2,5-dimethylphenyl)-5-propyltriazole-4-carboxylic acid Traditional Name: 1-(2,5-dimethylphenyl)-5-propyl-triazole-4-carboxylic acid Formula: C14H17N3O2 MolecularWeight: 259.30368

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(N=NN1C2=C(C=CC(=C2)C)C)C(=O)O

Isomeric SMILES

CCCC1=C(N=NN1C2=C(C=CC(=C2)C)C)C(=O)O

InChI

InChI=1S/C14H17N3O2/c1-4-5-11-13(14(18)19)15-16-17(11)12-8-9(2)6-7-10(12)3/h6-8H,4-5H2,1-3H3,(H,18,19)