1-[4-(4-methanoylphenyl)phenyl]-5-(2-morpholin-4-ylethoxy)pyrazole-4-carboxylic acid

Systemtic Name: 1-[4-(4-methanoylphenyl)phenyl]-5-(2-morpholin-4-ylethoxy)pyrazole-4-carboxylic acid Openeye Name: 1-[4-(4-formylphenyl)phenyl]-5-(2-morpholinoethoxy)pyrazole-4-carboxylic acid CAS Name: 1-[4-(4-formylphenyl)phenyl]-5-[2-(4-morpholinyl)ethoxy]-4-pyrazolecarboxylic acid IUPAC Name: 1-[4-(4-formylphenyl)phenyl]-5-(2-morpholin-4-ylethoxy)pyrazole-4-carboxylic acid Traditional Name: 1-[4-(4-formylphenyl)phenyl]-5-(2-morpholinoethoxy)pyrazole-4-carboxylic acid Formula: C23H23N3O5 MolecularWeight: 421.44582

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCOC2=C(C=NN2C3=CC=C(C=C3)C4=CC=C(C=C4)C=O)C(=O)O

Isomeric SMILES

C1COCCN1CCOC2=C(C=NN2C3=CC=C(C=C3)C4=CC=C(C=C4)C=O)C(=O)O

InChI

InChI=1S/C23H23N3O5/c27-16-17-1-3-18(4-2-17)19-5-7-20(8-6-19)26-22(21(15-24-26)23(28)29)31-14-11-25-9-12-30-13-10-25/h1-8,15-16H,9-14H2,(H,28,29)