butyl 3-[[4-[2-[(4-bromanyl-3-methyl-phenyl)amino]-2-oxidanylidene-ethoxy]-4-oxidanylidene-butanoyl]amino]benzoate

Systemtic Name: butyl 3-[[4-[2-[(4-bromanyl-3-methyl-phenyl)amino]-2-oxidanylidene-ethoxy]-4-oxidanylidene-butanoyl]amino]benzoate Openeye Name: butyl 3-[[4-[2-(4-bromo-3-methyl-anilino)-2-oxo-ethoxy]-4-oxo-butanoyl]amino]benzoate CAS Name: 3-[[4-[2-(4-bromo-3-methylanilino)-2-oxoethoxy]-1,4-dioxobutyl]amino]benzoic acid butyl ester IUPAC Name: butyl 3-[[4-[2-(4-bromo-3-methylanilino)-2-oxoethoxy]-4-oxobutanoyl]amino]benzoate Traditional Name: 3-[[4-[2-(4-bromo-3-methyl-anilino)-2-keto-ethoxy]-4-keto-butanoyl]amino]benzoic acid butyl ester Formula: C24H27BrN2O6 MolecularWeight: 519.38498

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC(=CC=C1)NC(=O)CCC(=O)OCC(=O)NC2=CC(=C(C=C2)Br)C

Isomeric SMILES

CCCCOC(=O)C1=CC(=CC=C1)NC(=O)CCC(=O)OCC(=O)NC2=CC(=C(C=C2)Br)C

InChI

InChI=1S/C24H27BrN2O6/c1-3-4-12-32-24(31)17-6-5-7-18(14-17)26-21(28)10-11-23(30)33-15-22(29)27-19-8-9-20(25)16(2)13-19/h5-9,13-14H,3-4,10-12,15H2,1-2H3,(H,26,28)(H,27,29)