ethyl 4-[(4Z)-4-[(5-bromanyl-2-ethoxy-phenyl)methylidene]-3,5-bis(oxidanylidene)pyrazolidin-1-yl]benzoate

Systemtic Name: ethyl 4-[(4Z)-4-[(5-bromanyl-2-ethoxy-phenyl)methylidene]-3,5-bis(oxidanylidene)pyrazolidin-1-yl]benzoate Openeye Name: ethyl 4-[(4Z)-4-[(5-bromo-2-ethoxy-phenyl)methylene]-3,5-dioxo-pyrazolidin-1-yl]benzoate CAS Name: 4-[(4Z)-4-[(5-bromo-2-ethoxyphenyl)methylidene]-3,5-dioxo-1-pyrazolidinyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(4Z)-4-[(5-bromo-2-ethoxyphenyl)methylidene]-3,5-dioxopyrazolidin-1-yl]benzoate Traditional Name: 4-[(4Z)-4-(5-bromo-2-ethoxy-benzylidene)-3,5-diketo-pyrazolidin-1-yl]benzoic acid ethyl ester Formula: C21H19BrN2O5 MolecularWeight: 459.28996

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Br)C=C2C(=O)NN(C2=O)C3=CC=C(C=C3)C(=O)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)Br)/C=C\2/C(=O)NN(C2=O)C3=CC=C(C=C3)C(=O)OCC

InChI

InChI=1S/C21H19BrN2O5/c1-3-28-18-10-7-15(22)11-14(18)12-17-19(25)23-24(20(17)26)16-8-5-13(6-9-16)21(27)29-4-2/h5-12H,3-4H2,1-2H3,(H,23,25)/b17-12-