ethyl 3-cyano-1-phenyl-pyrazole-4-carboxylate

Systemtic Name: ethyl 3-cyano-1-phenyl-pyrazole-4-carboxylate Openeye Name: ethyl 3-cyano-1-phenyl-pyrazole-4-carboxylate CAS Name: 3-cyano-1-phenyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 3-cyano-1-phenylpyrazole-4-carboxylate Traditional Name: 3-cyano-1-phenyl-pyrazole-4-carboxylic acid ethyl ester Formula: C13H11N3O2 MolecularWeight: 241.24534

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(N=C1C#N)C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1=CN(N=C1C#N)C2=CC=CC=C2

InChI

InChI=1S/C13H11N3O2/c1-2-18-13(17)11-9-16(15-12(11)8-14)10-6-4-3-5-7-10/h3-7,9H,2H2,1H3