ethyl 2-[2-bromanyl-4-[[[3-[(4-methylphenyl)amino]-3-oxidanylidene-propanoyl]hydrazinylidene]methyl]phenoxy]ethanoate

Systemtic Name: ethyl 2-[2-bromanyl-4-[[[3-[(4-methylphenyl)amino]-3-oxidanylidene-propanoyl]hydrazinylidene]methyl]phenoxy]ethanoate Openeye Name: ethyl 2-[2-bromo-4-[[[3-(4-methylanilino)-3-oxo-propanoyl]hydrazono]methyl]phenoxy]acetate CAS Name: 2-[2-bromo-4-[[[3-(4-methylanilino)-1,3-dioxopropyl]hydrazinylidene]methyl]phenoxy]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-bromo-4-[[[3-(4-methylanilino)-3-oxopropanoyl]hydrazinylidene]methyl]phenoxy]acetate Traditional Name: 2-[2-bromo-4-[[[3-keto-3-(p-toluidino)propanoyl]hydrazono]methyl]phenoxy]acetic acid ethyl ester Formula: C21H22BrN3O5 MolecularWeight: 476.32048

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)COC1=C(C=C(C=C1)C=NNC(=O)CC(=O)NC2=CC=C(C=C2)C)Br

Isomeric SMILES

CCOC(=O)COC1=C(C=C(C=C1)C=NNC(=O)CC(=O)NC2=CC=C(C=C2)C)Br

InChI

InChI=1S/C21H22BrN3O5/c1-3-29-21(28)13-30-18-9-6-15(10-17(18)22)12-23-25-20(27)11-19(26)24-16-7-4-14(2)5-8-16/h4-10,12H,3,11,13H2,1-2H3,(H,24,26)(H,25,27)