3-[(E)-C-[6-morpholin-4-yl-2-(2-pyridin-2-ylethoxy)pyrimidin-4-yl]carbonohydrazonoyl]benzoic acid

Systemtic Name: 3-[(E)-C-[6-morpholin-4-yl-2-(2-pyridin-2-ylethoxy)pyrimidin-4-yl]carbonohydrazonoyl]benzoic acid Openeye Name: 3-[(E)-[6-morpholino-2-[2-(2-pyridyl)ethoxy]pyrimidin-4-yl]carbonohydrazonoyl]benzoic acid CAS Name: 3-[(E)-hydrazinylidene-[6-(4-morpholinyl)-2-[2-(2-pyridinyl)ethoxy]-4-pyrimidinyl]methyl]benzoic acid IUPAC Name: 3-[(E)-C-[6-morpholin-4-yl-2-(2-pyridin-2-ylethoxy)pyrimidin-4-yl]carbonohydrazonoyl]benzoic acid Traditional Name: 3-[(E)-[6-morpholino-2-[2-(2-pyridyl)ethoxy]pyrimidin-4-yl]carbohydrazonoyl]benzoic acid Formula: C23H24N6O4 MolecularWeight: 448.47446

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC(=NC(=C2)C(=NN)C3=CC(=CC=C3)C(=O)O)OCCC4=CC=CC=N4

Isomeric SMILES

C1COCCN1C2=NC(=NC(=C2)/C(=N/N)/C3=CC(=CC=C3)C(=O)O)OCCC4=CC=CC=N4

InChI

InChI=1S/C23H24N6O4/c24-28-21(16-4-3-5-17(14-16)22(30)31)19-15-20(29-9-12-32-13-10-29)27-23(26-19)33-11-7-18-6-1-2-8-25-18/h1-6,8,14-15H,7,9-13,24H2,(H,30,31)/b28-21+