1-[4-(3-chlorophenyl)phenyl]-5-(2-morpholin-4-ylethoxy)pyrazole-4-carboxylic acid

Systemtic Name: 1-[4-(3-chlorophenyl)phenyl]-5-(2-morpholin-4-ylethoxy)pyrazole-4-carboxylic acid Openeye Name: 1-[4-(3-chlorophenyl)phenyl]-5-(2-morpholinoethoxy)pyrazole-4-carboxylic acid CAS Name: 1-[4-(3-chlorophenyl)phenyl]-5-[2-(4-morpholinyl)ethoxy]-4-pyrazolecarboxylic acid IUPAC Name: 1-[4-(3-chlorophenyl)phenyl]-5-(2-morpholin-4-ylethoxy)pyrazole-4-carboxylic acid Traditional Name: 1-[4-(3-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(=CC=C4)Cl)C(=O)O

Isomeric SMILES

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

InChI

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