1-(3-chloranyl-4-methyl-phenyl)-5-phenyl-pyrazole-3-carboxylic acid

Systemtic Name: 1-(3-chloranyl-4-methyl-phenyl)-5-phenyl-pyrazole-3-carboxylic acid Openeye Name: 1-(3-chloro-4-methyl-phenyl)-5-phenyl-pyrazole-3-carboxylic acid CAS Name: 1-(3-chloro-4-methylphenyl)-5-phenyl-3-pyrazolecarboxylic acid IUPAC Name: 1-(3-chloro-4-methylphenyl)-5-phenylpyrazole-3-carboxylic acid Traditional Name: 1-(3-chloro-4-methyl-phenyl)-5-phenyl-pyrazole-3-carboxylic acid Formula: C17H13ClN2O2 MolecularWeight: 312.75032

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=CC(=N2)C(=O)O)C3=CC=CC=C3)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=CC(=N2)C(=O)O)C3=CC=CC=C3)Cl

InChI

InChI=1S/C17H13ClN2O2/c1-11-7-8-13(9-14(11)18)20-16(10-15(19-20)17(21)22)12-5-3-2-4-6-12/h2-10H,1H3,(H,21,22)