ethyl 2-[4-[[3,5-bis(oxidanylidene)-1-phenyl-pyrazolidin-4-ylidene]methyl]-5-bromanyl-2-methoxy-phenoxy]propanoate

Systemtic Name: ethyl 2-[4-[[3,5-bis(oxidanylidene)-1-phenyl-pyrazolidin-4-ylidene]methyl]-5-bromanyl-2-methoxy-phenoxy]propanoate Openeye Name: ethyl 2-[5-bromo-4-[(3,5-dioxo-1-phenyl-pyrazolidin-4-ylidene)methyl]-2-methoxy-phenoxy]propanoate CAS Name: 2-[5-bromo-4-[(3,5-dioxo-1-phenyl-4-pyrazolidinylidene)methyl]-2-methoxyphenoxy]propanoic acid ethyl ester IUPAC Name: ethyl 2-[5-bromo-4-[(3,5-dioxo-1-phenylpyrazolidin-4-ylidene)methyl]-2-methoxyphenoxy]propanoate Traditional Name: 2-[5-bromo-4-[(3,5-diketo-1-phenyl-pyrazolidin-4-ylidene)methyl]-2-methoxy-phenoxy]propionic acid ethyl ester Formula: C22H21BrN2O6 MolecularWeight: 489.31594

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)OC1=C(C=C(C(=C1)Br)C=C2C(=O)NN(C2=O)C3=CC=CC=C3)OC

Isomeric SMILES

CCOC(=O)C(C)OC1=C(C=C(C(=C1)Br)C=C2C(=O)NN(C2=O)C3=CC=CC=C3)OC

InChI

InChI=1S/C22H21BrN2O6/c1-4-30-22(28)13(2)31-19-12-17(23)14(11-18(19)29-3)10-16-20(26)24-25(21(16)27)15-8-6-5-7-9-15/h5-13H,4H2,1-3H3,(H,24,26)