2-[5-ethoxycarbonyl-3-(4-morpholin-4-ylphenyl)pyrazol-1-yl]benzoic acid

Systemtic Name: 2-[5-ethoxycarbonyl-3-(4-morpholin-4-ylphenyl)pyrazol-1-yl]benzoic acid Openeye Name: 2-[5-ethoxycarbonyl-3-(4-morpholinophenyl)pyrazol-1-yl]benzoic acid CAS Name: 2-[5-ethoxycarbonyl-3-[4-(4-morpholinyl)phenyl]-1-pyrazolyl]benzoic acid IUPAC Name: 2-[5-ethoxycarbonyl-3-(4-morpholin-4-ylphenyl)pyrazol-1-yl]benzoic acid Traditional Name: 2-[5-carbethoxy-3-(4-morpholinophenyl)pyrazol-1-yl]benzoic acid Formula: C23H23N3O5 MolecularWeight: 421.44582

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=NN1C2=CC=CC=C2C(=O)O)C3=CC=C(C=C3)N4CCOCC4

Isomeric SMILES

CCOC(=O)C1=CC(=NN1C2=CC=CC=C2C(=O)O)C3=CC=C(C=C3)N4CCOCC4

InChI

InChI=1S/C23H23N3O5/c1-2-31-23(29)21-15-19(24-26(21)20-6-4-3-5-18(20)22(27)28)16-7-9-17(10-8-16)25-11-13-30-14-12-25/h3-10,15H,2,11-14H2,1H3,(H,27,28)