ethyl 1-[4-(2,6-dimethylphenyl)phenyl]-5-(2-morpholin-4-ylethoxy)pyrazole-4-carboxylate

Systemtic Name: ethyl 1-[4-(2,6-dimethylphenyl)phenyl]-5-(2-morpholin-4-ylethoxy)pyrazole-4-carboxylate Openeye Name: ethyl 1-[4-(2,6-dimethylphenyl)phenyl]-5-(2-morpholinoethoxy)pyrazole-4-carboxylate CAS Name: 1-[4-(2,6-dimethylphenyl)phenyl]-5-[2-(4-morpholinyl)ethoxy]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[4-(2,6-dimethylphenyl)phenyl]-5-(2-morpholin-4-ylethoxy)pyrazole-4-carboxylate Traditional Name: 1-[4-(2,6-dimethylphenyl)phenyl]-5-(2-morpholinoethoxy)pyrazole-4-carboxylic acid ethyl ester Formula: C26H31N3O4 MolecularWeight: 449.54204

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C3=C(C=CC=C3C)C)OCCN4CCOCC4

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C3=C(C=CC=C3C)C)OCCN4CCOCC4

InChI

InChI=1S/C26H31N3O4/c1-4-32-26(30)23-18-27-29(25(23)33-17-14-28-12-15-31-16-13-28)22-10-8-21(9-11-22)24-19(2)6-5-7-20(24)3/h5-11,18H,4,12-17H2,1-3H3