5-chloranyl-1-(3-cyanophenyl)-3-propan-2-yl-pyrazole-4-carboxylic acid

Systemtic Name: 5-chloranyl-1-(3-cyanophenyl)-3-propan-2-yl-pyrazole-4-carboxylic acid Openeye Name: 5-chloro-1-(3-cyanophenyl)-3-isopropyl-pyrazole-4-carboxylic acid CAS Name: 5-chloro-1-(3-cyanophenyl)-3-propan-2-yl-4-pyrazolecarboxylic acid IUPAC Name: 5-chloro-1-(3-cyanophenyl)-3-propan-2-ylpyrazole-4-carboxylic acid Traditional Name: 5-chloro-1-(3-cyanophenyl)-3-isopropyl-pyrazole-4-carboxylic acid Formula: C14H12ClN3O2 MolecularWeight: 289.71698

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN(C(=C1C(=O)O)Cl)C2=CC=CC(=C2)C#N

Isomeric SMILES

CC(C)C1=NN(C(=C1C(=O)O)Cl)C2=CC=CC(=C2)C#N

InChI

InChI=1S/C14H12ClN3O2/c1-8(2)12-11(14(19)20)13(15)18(17-12)10-5-3-4-9(6-10)7-16/h3-6,8H,1-2H3,(H,19,20)