ethyl 2-[4-[[3,5-bis(oxidanylidene)-1-phenyl-pyrazolidin-4-ylidene]methyl]-2-iodanyl-phenoxy]ethanoate

Systemtic Name: ethyl 2-[4-[[3,5-bis(oxidanylidene)-1-phenyl-pyrazolidin-4-ylidene]methyl]-2-iodanyl-phenoxy]ethanoate Openeye Name: ethyl 2-[4-[(3,5-dioxo-1-phenyl-pyrazolidin-4-ylidene)methyl]-2-iodo-phenoxy]acetate CAS Name: 2-[4-[(3,5-dioxo-1-phenyl-4-pyrazolidinylidene)methyl]-2-iodophenoxy]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-[(3,5-dioxo-1-phenylpyrazolidin-4-ylidene)methyl]-2-iodophenoxy]acetate Traditional Name: 2-[4-[(3,5-diketo-1-phenyl-pyrazolidin-4-ylidene)methyl]-2-iodo-phenoxy]acetic acid ethyl ester Formula: C20H17IN2O5 MolecularWeight: 492.26385

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)COC1=C(C=C(C=C1)C=C2C(=O)NN(C2=O)C3=CC=CC=C3)I

Isomeric SMILES

CCOC(=O)COC1=C(C=C(C=C1)C=C2C(=O)NN(C2=O)C3=CC=CC=C3)I

InChI

InChI=1S/C20H17IN2O5/c1-2-27-18(24)12-28-17-9-8-13(11-16(17)21)10-15-19(25)22-23(20(15)26)14-6-4-3-5-7-14/h3-11H,2,12H2,1H3,(H,22,25)