ethyl 2-[(1,3-diphenylpyrazol-4-yl)methylidene]-3-oxidanylidene-butanoate

Systemtic Name: ethyl 2-[(1,3-diphenylpyrazol-4-yl)methylidene]-3-oxidanylidene-butanoate Openeye Name: ethyl 2-[(1,3-diphenylpyrazol-4-yl)methylene]-3-oxo-butanoate CAS Name: 2-[(1,3-diphenyl-4-pyrazolyl)methylidene]-3-oxobutanoic acid ethyl ester IUPAC Name: ethyl 2-[(1,3-diphenylpyrazol-4-yl)methylidene]-3-oxobutanoate Traditional Name: 2-acetyl-3-(1,3-diphenylpyrazol-4-yl)acrylic acid ethyl ester Formula: C22H20N2O3 MolecularWeight: 360.4058

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1=CN(N=C1C2=CC=CC=C2)C3=CC=CC=C3)C(=O)C

Isomeric SMILES

CCOC(=O)C(=CC1=CN(N=C1C2=CC=CC=C2)C3=CC=CC=C3)C(=O)C

InChI

InChI=1S/C22H20N2O3/c1-3-27-22(26)20(16(2)25)14-18-15-24(19-12-8-5-9-13-19)23-21(18)17-10-6-4-7-11-17/h4-15H,3H2,1-2H3