(3-phenoxyphenyl)methyl 1-phenyl-3-pyridin-3-yl-pyrazole-4-carboxylate

Systemtic Name: (3-phenoxyphenyl)methyl 1-phenyl-3-pyridin-3-yl-pyrazole-4-carboxylate Openeye Name: (3-phenoxyphenyl)methyl 1-phenyl-3-(3-pyridyl)pyrazole-4-carboxylate CAS Name: 1-phenyl-3-(3-pyridinyl)-4-pyrazolecarboxylic acid (3-phenoxyphenyl)methyl ester IUPAC Name: (3-phenoxyphenyl)methyl 1-phenyl-3-pyridin-3-ylpyrazole-4-carboxylate Traditional Name: 1-phenyl-3-(3-pyridyl)pyrazole-4-carboxylic acid (3-phenoxybenzyl) ester Formula: C28H21N3O3 MolecularWeight: 447.48464

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CN=CC=C3)C(=O)OCC4=CC(=CC=C4)OC5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CN=CC=C3)C(=O)OCC4=CC(=CC=C4)OC5=CC=CC=C5

InChI

InChI=1S/C28H21N3O3/c32-28(33-20-21-9-7-15-25(17-21)34-24-13-5-2-6-14-24)26-19-31(23-11-3-1-4-12-23)30-27(26)22-10-8-16-29-18-22/h1-19H,20H2