(4-cyano-2-methoxy-phenyl) 5-cyclopropyl-2-phenyl-pyrazole-3-carboxylate

Systemtic Name: (4-cyano-2-methoxy-phenyl) 5-cyclopropyl-2-phenyl-pyrazole-3-carboxylate Openeye Name: (4-cyano-2-methoxy-phenyl) 5-cyclopropyl-2-phenyl-pyrazole-3-carboxylate CAS Name: 5-cyclopropyl-2-phenyl-3-pyrazolecarboxylic acid (4-cyano-2-methoxyphenyl) ester IUPAC Name: (4-cyano-2-methoxyphenyl) 5-cyclopropyl-2-phenylpyrazole-3-carboxylate Traditional Name: 5-cyclopropyl-2-phenyl-pyrazole-3-carboxylic acid (4-cyano-2-methoxy-phenyl) ester Formula: C21H17N3O3 MolecularWeight: 359.37798

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C#N)OC(=O)C2=CC(=NN2C3=CC=CC=C3)C4CC4

Isomeric SMILES

COC1=C(C=CC(=C1)C#N)OC(=O)C2=CC(=NN2C3=CC=CC=C3)C4CC4

InChI

InChI=1S/C21H17N3O3/c1-26-20-11-14(13-22)7-10-19(20)27-21(25)18-12-17(15-8-9-15)23-24(18)16-5-3-2-4-6-16/h2-7,10-12,15H,8-9H2,1H3