1-(3-chlorophenyl)-3-phenethyl-5-phenyl-pyrazole-4-carboxylic acid

Systemtic Name: 1-(3-chlorophenyl)-3-phenethyl-5-phenyl-pyrazole-4-carboxylic acid Openeye Name: 1-(3-chlorophenyl)-3-phenethyl-5-phenyl-pyrazole-4-carboxylic acid CAS Name: 1-(3-chlorophenyl)-3-phenethyl-5-phenyl-4-pyrazolecarboxylic acid IUPAC Name: 1-(3-chlorophenyl)-3-phenethyl-5-phenylpyrazole-4-carboxylic acid Traditional Name: 1-(3-chlorophenyl)-3-phenethyl-5-phenyl-pyrazole-4-carboxylic acid Formula: C24H19ClN2O2 MolecularWeight: 402.87286

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC2=NN(C(=C2C(=O)O)C3=CC=CC=C3)C4=CC(=CC=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)CCC2=NN(C(=C2C(=O)O)C3=CC=CC=C3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C24H19ClN2O2/c25-19-12-7-13-20(16-19)27-23(18-10-5-2-6-11-18)22(24(28)29)21(26-27)15-14-17-8-3-1-4-9-17/h1-13,16H,14-15H2,(H,28,29)