ethyl 4-(4-cyano-3-phenylmethoxy-pyrazol-1-yl)benzoate

Systemtic Name: ethyl 4-(4-cyano-3-phenylmethoxy-pyrazol-1-yl)benzoate Openeye Name: ethyl 4-(3-benzyloxy-4-cyano-pyrazol-1-yl)benzoate CAS Name: 4-(4-cyano-3-phenylmethoxy-1-pyrazolyl)benzoic acid ethyl ester IUPAC Name: ethyl 4-(4-cyano-3-phenylmethoxypyrazol-1-yl)benzoate Traditional Name: 4-(3-benzoxy-4-cyano-pyrazol-1-yl)benzoic acid ethyl ester Formula: C20H17N3O3 MolecularWeight: 347.36728

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N2C=C(C(=N2)OCC3=CC=CC=C3)C#N

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N2C=C(C(=N2)OCC3=CC=CC=C3)C#N

InChI

InChI=1S/C20H17N3O3/c1-2-25-20(24)16-8-10-18(11-9-16)23-13-17(12-21)19(22-23)26-14-15-6-4-3-5-7-15/h3-11,13H,2,14H2,1H3