ethyl 4-[(4E)-4-[[3-methoxy-4-(2-oxidanylidene-2-propan-2-yloxy-ethoxy)phenyl]methylidene]-3-methyl-5-oxidanylidene-pyrazol-1-yl]benzoate

Systemtic Name: ethyl 4-[(4E)-4-[[3-methoxy-4-(2-oxidanylidene-2-propan-2-yloxy-ethoxy)phenyl]methylidene]-3-methyl-5-oxidanylidene-pyrazol-1-yl]benzoate Openeye Name: ethyl 4-[(4E)-4-[[4-(2-isopropoxy-2-oxo-ethoxy)-3-methoxy-phenyl]methylene]-3-methyl-5-oxo-pyrazol-1-yl]benzoate CAS Name: 4-[(4E)-4-[[3-methoxy-4-(2-oxo-2-propan-2-yloxyethoxy)phenyl]methylidene]-3-methyl-5-oxo-1-pyrazolyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(4E)-4-[[3-methoxy-4-(2-oxo-2-propan-2-yloxyethoxy)phenyl]methylidene]-3-methyl-5-oxopyrazol-1-yl]benzoate Traditional Name: 4-[(4E)-4-[4-(2-isopropoxy-2-keto-ethoxy)-3-methoxy-benzylidene]-5-keto-3-methyl-2-pyrazolin-1-yl]benzoic acid ethyl ester Formula: C26H28N2O7 MolecularWeight: 480.50972

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N2C(=O)C(=CC3=CC(=C(C=C3)OCC(=O)OC(C)C)OC)C(=N2)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N2C(=O)/C(=C/C3=CC(=C(C=C3)OCC(=O)OC(C)C)OC)/C(=N2)C

InChI

InChI=1S/C26H28N2O7/c1-6-33-26(31)19-8-10-20(11-9-19)28-25(30)21(17(4)27-28)13-18-7-12-22(23(14-18)32-5)34-15-24(29)35-16(2)3/h7-14,16H,6,15H2,1-5H3/b21-13+