4-(3-oxidanylpropyl)-1-(4-propylphenyl)pyrazole-3-carboxylic acid

Systemtic Name: 4-(3-oxidanylpropyl)-1-(4-propylphenyl)pyrazole-3-carboxylic acid Openeye Name: 4-(3-hydroxypropyl)-1-(4-propylphenyl)pyrazole-3-carboxylic acid CAS Name: 4-(3-hydroxypropyl)-1-(4-propylphenyl)-3-pyrazolecarboxylic acid IUPAC Name: 4-(3-hydroxypropyl)-1-(4-propylphenyl)pyrazole-3-carboxylic acid Traditional Name: 4-(3-hydroxypropyl)-1-(4-propylphenyl)pyrazole-3-carboxylic acid Formula: C16H20N2O3 MolecularWeight: 288.3416

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)N2C=C(C(=N2)C(=O)O)CCCO

Isomeric SMILES

CCCC1=CC=C(C=C1)N2C=C(C(=N2)C(=O)O)CCCO

InChI

InChI=1S/C16H20N2O3/c1-2-4-12-6-8-14(9-7-12)18-11-13(5-3-10-19)15(17-18)16(20)21/h6-9,11,19H,2-5,10H2,1H3,(H,20,21)