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

Systemtic Name: 1-[4-(4-chlorophenyl)phenyl]-5-(2-morpholin-4-ylethoxy)pyrazole-4-carboxylic acid Openeye Name: 1-[4-(4-chlorophenyl)phenyl]-5-(2-morpholinoethoxy)pyrazole-4-carboxylic acid CAS Name: 1-[4-(4-chlorophenyl)phenyl]-5-[2-(4-morpholinyl)ethoxy]-4-pyrazolecarboxylic acid IUPAC Name: 1-[4-(4-chlorophenyl)phenyl]-5-(2-morpholin-4-ylethoxy)pyrazole-4-carboxylic acid Traditional Name: 1-[4-(4-chlorophenyl)phenyl]-5-(2-morpholinoethoxy)pyrazole-4-carboxylic acid Formula: C22H22ClN3O4 MolecularWeight: 427.88078

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22ClN3O4/c23-18-5-1-16(2-6-18)17-3-7-19(8-4-17)26-21(20(15-24-26)22(27)28)30-14-11-25-9-12-29-13-10-25/h1-8,15H,9-14H2,(H,27,28)