ethyl (4Z)-5-oxidanylidene-1-phenyl-4-[(3,4,5-trimethoxyphenyl)methylidene]pyrazole-3-carboxylate

Systemtic Name: ethyl (4Z)-5-oxidanylidene-1-phenyl-4-[(3,4,5-trimethoxyphenyl)methylidene]pyrazole-3-carboxylate Openeye Name: ethyl (4Z)-5-oxo-1-phenyl-4-[(3,4,5-trimethoxyphenyl)methylene]pyrazole-3-carboxylate CAS Name: (4Z)-5-oxo-1-phenyl-4-[(3,4,5-trimethoxyphenyl)methylidene]-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl (4Z)-5-oxo-1-phenyl-4-[(3,4,5-trimethoxyphenyl)methylidene]pyrazole-3-carboxylate Traditional Name: (4Z)-5-keto-1-phenyl-4-(3,4,5-trimethoxybenzylidene)-2-pyrazoline-3-carboxylic acid ethyl ester Formula: C22H22N2O6 MolecularWeight: 410.41988

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=O)C1=CC2=CC(=C(C(=C2)OC)OC)OC)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C\1=NN(C(=O)/C1=C\C2=CC(=C(C(=C2)OC)OC)OC)C3=CC=CC=C3

InChI

InChI=1S/C22H22N2O6/c1-5-30-22(26)19-16(21(25)24(23-19)15-9-7-6-8-10-15)11-14-12-17(27-2)20(29-4)18(13-14)28-3/h6-13H,5H2,1-4H3/b16-11-