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

Systemtic Name: methyl 2-[2-bromanyl-6-ethoxy-4-[[(4-oxidanylidene-4-phenylazanyl-butanoyl)hydrazinylidene]methyl]phenoxy]ethanoate Openeye Name: methyl 2-[4-[[(4-anilino-4-oxo-butanoyl)hydrazono]methyl]-2-bromo-6-ethoxy-phenoxy]acetate CAS Name: 2-[4-[[(4-anilino-1,4-dioxobutyl)hydrazinylidene]methyl]-2-bromo-6-ethoxyphenoxy]acetic acid methyl ester IUPAC Name: methyl 2-[4-[[(4-anilino-4-oxobutanoyl)hydrazinylidene]methyl]-2-bromo-6-ethoxyphenoxy]acetate Traditional Name: 2-[4-[[(4-anilino-4-keto-butanoyl)hydrazono]methyl]-2-bromo-6-ethoxy-phenoxy]acetic acid methyl ester Formula: C22H24BrN3O6 MolecularWeight: 506.34646

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24BrN3O6/c1-3-31-18-12-15(11-17(23)22(18)32-14-21(29)30-2)13-24-26-20(28)10-9-19(27)25-16-7-5-4-6-8-16/h4-8,11-13H,3,9-10,14H2,1-2H3,(H,25,27)(H,26,28)