1-(4-butylphenyl)-5-cyclopropyl-1,2,3-triazole-4-carboxylic acid

Systemtic Name: 1-(4-butylphenyl)-5-cyclopropyl-1,2,3-triazole-4-carboxylic acid Openeye Name: 1-(4-butylphenyl)-5-cyclopropyl-triazole-4-carboxylic acid CAS Name: 1-(4-butylphenyl)-5-cyclopropyl-4-triazolecarboxylic acid IUPAC Name: 1-(4-butylphenyl)-5-cyclopropyltriazole-4-carboxylic acid Traditional Name: 1-(4-butylphenyl)-5-cyclopropyl-triazole-4-carboxylic acid Formula: C16H19N3O2 MolecularWeight: 285.34096

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)N2C(=C(N=N2)C(=O)O)C3CC3

Isomeric SMILES

CCCCC1=CC=C(C=C1)N2C(=C(N=N2)C(=O)O)C3CC3

InChI

InChI=1S/C16H19N3O2/c1-2-3-4-11-5-9-13(10-6-11)19-15(12-7-8-12)14(16(20)21)17-18-19/h5-6,9-10,12H,2-4,7-8H2,1H3,(H,20,21)