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

Systemtic Name: 1-(3-propan-2-ylphenyl)-5-propyl-1,2,3-triazole-4-carboxylic acid Openeye Name: 1-(3-isopropylphenyl)-5-propyl-triazole-4-carboxylic acid CAS Name: 1-(3-propan-2-ylphenyl)-5-propyl-4-triazolecarboxylic acid IUPAC Name: 1-(3-propan-2-ylphenyl)-5-propyltriazole-4-carboxylic acid Traditional Name: 1-m-cumenyl-5-propyl-triazole-4-carboxylic acid Formula: C15H19N3O2 MolecularWeight: 273.33026

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19N3O2/c1-4-6-13-14(15(19)20)16-17-18(13)12-8-5-7-11(9-12)10(2)3/h5,7-10H,4,6H2,1-3H3,(H,19,20)