ethyl 2-[2-ethoxy-6-iodanyl-4-[[(4-oxidanylidene-4-phenylazanyl-butanoyl)hydrazinylidene]methyl]phenoxy]ethanoate

Systemtic Name: ethyl 2-[2-ethoxy-6-iodanyl-4-[[(4-oxidanylidene-4-phenylazanyl-butanoyl)hydrazinylidene]methyl]phenoxy]ethanoate Openeye Name: ethyl 2-[4-[[(4-anilino-4-oxo-butanoyl)hydrazono]methyl]-2-ethoxy-6-iodo-phenoxy]acetate CAS Name: 2-[4-[[(4-anilino-1,4-dioxobutyl)hydrazinylidene]methyl]-2-ethoxy-6-iodophenoxy]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-[[(4-anilino-4-oxobutanoyl)hydrazinylidene]methyl]-2-ethoxy-6-iodophenoxy]acetate Traditional Name: 2-[4-[[(4-anilino-4-keto-butanoyl)hydrazono]methyl]-2-ethoxy-6-iodo-phenoxy]acetic acid ethyl ester Formula: C23H26IN3O6 MolecularWeight: 567.37351

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=NNC(=O)CCC(=O)NC2=CC=CC=C2)I)OCC(=O)OCC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C=NNC(=O)CCC(=O)NC2=CC=CC=C2)I)OCC(=O)OCC

InChI

InChI=1S/C23H26IN3O6/c1-3-31-19-13-16(12-18(24)23(19)33-15-22(30)32-4-2)14-25-27-21(29)11-10-20(28)26-17-8-6-5-7-9-17/h5-9,12-14H,3-4,10-11,15H2,1-2H3,(H,26,28)(H,27,29)