[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methyl 6-morpholin-4-ylpyridine-3-carboxylate

Systemtic Name: [3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methyl 6-morpholin-4-ylpyridine-3-carboxylate Openeye Name: [3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methyl 6-morpholinopyridine-3-carboxylate CAS Name: 6-(4-morpholinyl)-3-pyridinecarboxylic acid [3-(4-methoxyphenyl)-1-phenyl-4-pyrazolyl]methyl ester IUPAC Name: [3-(4-methoxyphenyl)-1-phenylpyrazol-4-yl]methyl 6-morpholin-4-ylpyridine-3-carboxylate Traditional Name: 6-morpholinonicotinic acid [3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methyl ester Formula: C27H26N4O4 MolecularWeight: 470.51974

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN(C=C2COC(=O)C3=CN=C(C=C3)N4CCOCC4)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN(C=C2COC(=O)C3=CN=C(C=C3)N4CCOCC4)C5=CC=CC=C5

InChI

InChI=1S/C27H26N4O4/c1-33-24-10-7-20(8-11-24)26-22(18-31(29-26)23-5-3-2-4-6-23)19-35-27(32)21-9-12-25(28-17-21)30-13-15-34-16-14-30/h2-12,17-18H,13-16,19H2,1H3