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

Systemtic Name: 1-(4-butylphenyl)-5-propyl-1,2,3-triazole-4-carboxylic acid Openeye Name: 1-(4-butylphenyl)-5-propyl-triazole-4-carboxylic acid CAS Name: 1-(4-butylphenyl)-5-propyl-4-triazolecarboxylic acid IUPAC Name: 1-(4-butylphenyl)-5-propyltriazole-4-carboxylic acid Traditional Name: 1-(4-butylphenyl)-5-propyl-triazole-4-carboxylic acid Formula: C16H21N3O2 MolecularWeight: 287.35684

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21N3O2/c1-3-5-7-12-8-10-13(11-9-12)19-14(6-4-2)15(16(20)21)17-18-19/h8-11H,3-7H2,1-2H3,(H,20,21)