ethyl 5-(2-morpholin-4-ylethoxy)-1-[4-(2-phenylmethoxyphenyl)phenyl]pyrazole-4-carboxylate

Systemtic Name: ethyl 5-(2-morpholin-4-ylethoxy)-1-[4-(2-phenylmethoxyphenyl)phenyl]pyrazole-4-carboxylate Openeye Name: ethyl 1-[4-(2-benzyloxyphenyl)phenyl]-5-(2-morpholinoethoxy)pyrazole-4-carboxylate CAS Name: 5-[2-(4-morpholinyl)ethoxy]-1-[4-(2-phenylmethoxyphenyl)phenyl]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(2-morpholin-4-ylethoxy)-1-[4-(2-phenylmethoxyphenyl)phenyl]pyrazole-4-carboxylate Traditional Name: 1-[4-(2-benzoxyphenyl)phenyl]-5-(2-morpholinoethoxy)pyrazole-4-carboxylic acid ethyl ester Formula: C31H33N3O5 MolecularWeight: 527.61082

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C3=CC=CC=C3OCC4=CC=CC=C4)OCCN5CCOCC5

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C3=CC=CC=C3OCC4=CC=CC=C4)OCCN5CCOCC5

InChI

InChI=1S/C31H33N3O5/c1-2-37-31(35)28-22-32-34(30(28)38-21-18-33-16-19-36-20-17-33)26-14-12-25(13-15-26)27-10-6-7-11-29(27)39-23-24-8-4-3-5-9-24/h3-15,22H,2,16-21,23H2,1H3