3-[3-(4-morpholin-4-ylphenyl)pyrazol-1-yl]benzoic acid

Systemtic Name: 3-[3-(4-morpholin-4-ylphenyl)pyrazol-1-yl]benzoic acid Openeye Name: 3-[3-(4-morpholinophenyl)pyrazol-1-yl]benzoic acid CAS Name: 3-[3-[4-(4-morpholinyl)phenyl]-1-pyrazolyl]benzoic acid IUPAC Name: 3-[3-(4-morpholin-4-ylphenyl)pyrazol-1-yl]benzoic acid Traditional Name: 3-[3-(4-morpholinophenyl)pyrazol-1-yl]benzoic acid Formula: C20H19N3O3 MolecularWeight: 349.38316

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC=C(C=C2)C3=NN(C=C3)C4=CC=CC(=C4)C(=O)O

Isomeric SMILES

C1COCCN1C2=CC=C(C=C2)C3=NN(C=C3)C4=CC=CC(=C4)C(=O)O

InChI

InChI=1S/C20H19N3O3/c24-20(25)16-2-1-3-18(14-16)23-9-8-19(21-23)15-4-6-17(7-5-15)22-10-12-26-13-11-22/h1-9,14H,10-13H2,(H,24,25)