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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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