5-cyano-4-[4-(2-ethoxyphenyl)phenyl]-2-methyl-pyrazole-3-carboxylic acid

Systemtic Name: 5-cyano-4-[4-(2-ethoxyphenyl)phenyl]-2-methyl-pyrazole-3-carboxylic acid Openeye Name: 5-cyano-4-[4-(2-ethoxyphenyl)phenyl]-2-methyl-pyrazole-3-carboxylic acid CAS Name: 5-cyano-4-[4-(2-ethoxyphenyl)phenyl]-2-methyl-3-pyrazolecarboxylic acid IUPAC Name: 5-cyano-4-[4-(2-ethoxyphenyl)phenyl]-2-methylpyrazole-3-carboxylic acid Traditional Name: 5-cyano-2-methyl-4-(4-o-phenetylphenyl)pyrazole-3-carboxylic acid Formula: C20H17N3O3 MolecularWeight: 347.36728

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C2=CC=C(C=C2)C3=C(N(N=C3C#N)C)C(=O)O

Isomeric SMILES

CCOC1=CC=CC=C1C2=CC=C(C=C2)C3=C(N(N=C3C#N)C)C(=O)O

InChI

InChI=1S/C20H17N3O3/c1-3-26-17-7-5-4-6-15(17)13-8-10-14(11-9-13)18-16(12-21)22-23(2)19(18)20(24)25/h4-11H,3H2,1-2H3,(H,24,25)