ethyl 5-(3,4-dimethoxyphenyl)carbonyloxy-1-phenyl-pyrazole-3-carboxylate

Systemtic Name: ethyl 5-(3,4-dimethoxyphenyl)carbonyloxy-1-phenyl-pyrazole-3-carboxylate Openeye Name: ethyl 5-(3,4-dimethoxybenzoyl)oxy-1-phenyl-pyrazole-3-carboxylate CAS Name: 5-[(3,4-dimethoxyphenyl)-oxomethoxy]-1-phenyl-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(3,4-dimethoxybenzoyl)oxy-1-phenylpyrazole-3-carboxylate Traditional Name: 1-phenyl-5-veratroyloxy-pyrazole-3-carboxylic acid ethyl ester Formula: C21H20N2O6 MolecularWeight: 396.3933

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=C1)OC(=O)C2=CC(=C(C=C2)OC)OC)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=NN(C(=C1)OC(=O)C2=CC(=C(C=C2)OC)OC)C3=CC=CC=C3

InChI

InChI=1S/C21H20N2O6/c1-4-28-21(25)16-13-19(23(22-16)15-8-6-5-7-9-15)29-20(24)14-10-11-17(26-2)18(12-14)27-3/h5-13H,4H2,1-3H3