4-(3-oxidanylpropyl)-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylic acid

Systemtic Name: 4-(3-oxidanylpropyl)-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylic acid Openeye Name: 4-(3-hydroxypropyl)-1-(2-isopropylphenyl)pyrazole-3-carboxylic acid CAS Name: 4-(3-hydroxypropyl)-1-(2-propan-2-ylphenyl)-3-pyrazolecarboxylic acid IUPAC Name: 4-(3-hydroxypropyl)-1-(2-propan-2-ylphenyl)pyrazole-3-carboxylic acid Traditional Name: 4-(3-hydroxypropyl)-1-o-cumenyl-pyrazole-3-carboxylic acid Formula: C16H20N2O3 MolecularWeight: 288.3416

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1N2C=C(C(=N2)C(=O)O)CCCO

Isomeric SMILES

CC(C)C1=CC=CC=C1N2C=C(C(=N2)C(=O)O)CCCO

InChI

InChI=1S/C16H20N2O3/c1-11(2)13-7-3-4-8-14(13)18-10-12(6-5-9-19)15(17-18)16(20)21/h3-4,7-8,10-11,19H,5-6,9H2,1-2H3,(H,20,21)