5-(3,4-dichlorophenyl)-1-(4,6-dimethylpyrimidin-2-yl)pyrazole-3-carboxylic acid

Systemtic Name: 5-(3,4-dichlorophenyl)-1-(4,6-dimethylpyrimidin-2-yl)pyrazole-3-carboxylic acid Openeye Name: 5-(3,4-dichlorophenyl)-1-(4,6-dimethylpyrimidin-2-yl)pyrazole-3-carboxylic acid CAS Name: 5-(3,4-dichlorophenyl)-1-(4,6-dimethyl-2-pyrimidinyl)-3-pyrazolecarboxylic acid IUPAC Name: 5-(3,4-dichlorophenyl)-1-(4,6-dimethylpyrimidin-2-yl)pyrazole-3-carboxylic acid Traditional Name: 5-(3,4-dichlorophenyl)-1-(4,6-dimethylpyrimidin-2-yl)pyrazole-3-carboxylic acid Formula: C16H12Cl2N4O2 MolecularWeight: 363.19808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2C(=CC(=N2)C(=O)O)C3=CC(=C(C=C3)Cl)Cl)C

Isomeric SMILES

CC1=CC(=NC(=N1)N2C(=CC(=N2)C(=O)O)C3=CC(=C(C=C3)Cl)Cl)C

InChI

InChI=1S/C16H12Cl2N4O2/c1-8-5-9(2)20-16(19-8)22-14(7-13(21-22)15(23)24)10-3-4-11(17)12(18)6-10/h3-7H,1-2H3,(H,23,24)