ethyl 5-phenyl-1H-pyrazole-4-carboxylate

Systemtic Name: ethyl 5-phenyl-1H-pyrazole-4-carboxylate Openeye Name: ethyl 5-phenyl-1H-pyrazole-4-carboxylate CAS Name: 5-phenyl-1H-pyrazole-4-carboxylic acid ethyl ester IUPAC Name: ethyl 5-phenyl-1H-pyrazole-4-carboxylate Traditional Name: 5-phenyl-1H-pyrazole-4-carboxylic acid ethyl ester Formula: C12H12N2O2 MolecularWeight: 216.23588

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NN=C1)C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1=C(NN=C1)C2=CC=CC=C2

InChI

InChI=1S/C12H12N2O2/c1-2-16-12(15)10-8-13-14-11(10)9-6-4-3-5-7-9/h3-8H,2H2,1H3,(H,13,14)