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

Systemtic Name: 4-methanoyl-1-(4-propan-2-ylphenyl)pyrazole-3-carboxylic acid Openeye Name: 4-formyl-1-(4-isopropylphenyl)pyrazole-3-carboxylic acid CAS Name: 4-formyl-1-(4-propan-2-ylphenyl)-3-pyrazolecarboxylic acid IUPAC Name: 4-formyl-1-(4-propan-2-ylphenyl)pyrazole-3-carboxylic acid Traditional Name: 4-formyl-1-p-cumenyl-pyrazole-3-carboxylic acid Formula: C14H14N2O3 MolecularWeight: 258.27256

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H14N2O3/c1-9(2)10-3-5-12(6-4-10)16-7-11(8-17)13(15-16)14(18)19/h3-9H,1-2H3,(H,18,19)