1-[4-(2,4-dichlorophenyl)phenyl]-5-(2-morpholin-4-ylethoxy)pyrazole-4-carboxylate

Systemtic Name: 1-[4-(2,4-dichlorophenyl)phenyl]-5-(2-morpholin-4-ylethoxy)pyrazole-4-carboxylate Openeye Name: 1-[4-(2,4-dichlorophenyl)phenyl]-5-(2-morpholinoethoxy)pyrazole-4-carboxylate CAS Name: 1-[4-(2,4-dichlorophenyl)phenyl]-5-[2-(4-morpholinyl)ethoxy]-4-pyrazolecarboxylate IUPAC Name: 1-[4-(2,4-dichlorophenyl)phenyl]-5-(2-morpholin-4-ylethoxy)pyrazole-4-carboxylate Traditional Name: 1-[4-(2,4-dichlorophenyl)phenyl]-5-(2-morpholinoethoxy)pyrazole-4-carboxylate Formula: C22H20Cl2N3O4- MolecularWeight: 461.3179

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCOC2=C(C=NN2C3=CC=C(C=C3)C4=C(C=C(C=C4)Cl)Cl)C(=O)[O-]

Isomeric SMILES

C1COCCN1CCOC2=C(C=NN2C3=CC=C(C=C3)C4=C(C=C(C=C4)Cl)Cl)C(=O)[O-]

InChI

InChI=1S/C22H21Cl2N3O4/c23-16-3-6-18(20(24)13-16)15-1-4-17(5-2-15)27-21(19(14-25-27)22(28)29)31-12-9-26-7-10-30-11-8-26/h1-6,13-14H,7-12H2,(H,28,29)/p-1