ethyl 4-[[4-[2-[(4-bromanyl-2-ethyl-phenyl)amino]-2-oxidanylidene-ethoxy]-4-oxidanylidene-butanoyl]amino]benzoate

Systemtic Name: ethyl 4-[[4-[2-[(4-bromanyl-2-ethyl-phenyl)amino]-2-oxidanylidene-ethoxy]-4-oxidanylidene-butanoyl]amino]benzoate Openeye Name: ethyl 4-[[4-[2-(4-bromo-2-ethyl-anilino)-2-oxo-ethoxy]-4-oxo-butanoyl]amino]benzoate CAS Name: 4-[[4-[2-(4-bromo-2-ethylanilino)-2-oxoethoxy]-1,4-dioxobutyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[4-[2-(4-bromo-2-ethylanilino)-2-oxoethoxy]-4-oxobutanoyl]amino]benzoate Traditional Name: 4-[[4-[2-(4-bromo-2-ethyl-anilino)-2-keto-ethoxy]-4-keto-butanoyl]amino]benzoic acid ethyl ester Formula: C23H25BrN2O6 MolecularWeight: 505.3584

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)Br)NC(=O)COC(=O)CCC(=O)NC2=CC=C(C=C2)C(=O)OCC

Isomeric SMILES

CCC1=C(C=CC(=C1)Br)NC(=O)COC(=O)CCC(=O)NC2=CC=C(C=C2)C(=O)OCC

InChI

InChI=1S/C23H25BrN2O6/c1-3-15-13-17(24)7-10-19(15)26-21(28)14-32-22(29)12-11-20(27)25-18-8-5-16(6-9-18)23(30)31-4-2/h5-10,13H,3-4,11-12,14H2,1-2H3,(H,25,27)(H,26,28)