1-(3-chlorophenyl)-3-phenethyl-5-propan-2-yl-pyrazole-4-carboxylic acid

Systemtic Name: 1-(3-chlorophenyl)-3-phenethyl-5-propan-2-yl-pyrazole-4-carboxylic acid Openeye Name: 1-(3-chlorophenyl)-5-isopropyl-3-phenethyl-pyrazole-4-carboxylic acid CAS Name: 1-(3-chlorophenyl)-3-phenethyl-5-propan-2-yl-4-pyrazolecarboxylic acid IUPAC Name: 1-(3-chlorophenyl)-3-phenethyl-5-propan-2-ylpyrazole-4-carboxylic acid Traditional Name: 1-(3-chlorophenyl)-5-isopropyl-3-phenethyl-pyrazole-4-carboxylic acid Formula: C21H21ClN2O2 MolecularWeight: 368.85664

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=NN1C2=CC(=CC=C2)Cl)CCC3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC(C)C1=C(C(=NN1C2=CC(=CC=C2)Cl)CCC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C21H21ClN2O2/c1-14(2)20-19(21(25)26)18(12-11-15-7-4-3-5-8-15)23-24(20)17-10-6-9-16(22)13-17/h3-10,13-14H,11-12H2,1-2H3,(H,25,26)