[2-(3-chlorophenyl)-5-ethyl-pyrazol-3-yl] 2-phenylbutanoate

Systemtic Name: [2-(3-chlorophenyl)-5-ethyl-pyrazol-3-yl] 2-phenylbutanoate Openeye Name: [2-(3-chlorophenyl)-5-ethyl-pyrazol-3-yl] 2-phenylbutanoate CAS Name: 2-phenylbutanoic acid [2-(3-chlorophenyl)-5-ethyl-3-pyrazolyl] ester IUPAC Name: [2-(3-chlorophenyl)-5-ethylpyrazol-3-yl] 2-phenylbutanoate Traditional Name: 2-phenylbutyric acid [2-(3-chlorophenyl)-5-ethyl-pyrazol-3-yl] ester Formula: C21H21ClN2O2 MolecularWeight: 368.85664

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(=C1)OC(=O)C(CC)C2=CC=CC=C2)C3=CC(=CC=C3)Cl

Isomeric SMILES

CCC1=NN(C(=C1)OC(=O)C(CC)C2=CC=CC=C2)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C21H21ClN2O2/c1-3-17-14-20(24(23-17)18-12-8-11-16(22)13-18)26-21(25)19(4-2)15-9-6-5-7-10-15/h5-14,19H,3-4H2,1-2H3