ethyl 2-(2-oxidanyl-3-phenoxy-propyl)-5-phenyl-pyrazole-3-carboxylate

Systemtic Name: ethyl 2-(2-oxidanyl-3-phenoxy-propyl)-5-phenyl-pyrazole-3-carboxylate Openeye Name: ethyl 2-(2-hydroxy-3-phenoxy-propyl)-5-phenyl-pyrazole-3-carboxylate CAS Name: 2-(2-hydroxy-3-phenoxypropyl)-5-phenyl-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(2-hydroxy-3-phenoxypropyl)-5-phenylpyrazole-3-carboxylate Traditional Name: 2-(2-hydroxy-3-phenoxy-propyl)-5-phenyl-pyrazole-3-carboxylic acid ethyl ester Formula: C21H22N2O4 MolecularWeight: 366.41038

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=NN1CC(COC2=CC=CC=C2)O)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=CC(=NN1CC(COC2=CC=CC=C2)O)C3=CC=CC=C3

InChI

InChI=1S/C21H22N2O4/c1-2-26-21(25)20-13-19(16-9-5-3-6-10-16)22-23(20)14-17(24)15-27-18-11-7-4-8-12-18/h3-13,17,24H,2,14-15H2,1H3