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

Systemtic Name: 2-methylpropyl 4-[2-[4-[(4-bromanyl-2-methyl-phenyl)amino]-4-oxidanylidene-butanoyl]oxyethanoylamino]benzoate Openeye Name: isobutyl 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 2-methylpropyl ester IUPAC Name: 2-methylpropyl 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 isobutyl ester Formula: C24H27BrN2O6 MolecularWeight: 519.38498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)CCC(=O)OCC(=O)NC2=CC=C(C=C2)C(=O)OCC(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CCC(=O)OCC(=O)NC2=CC=C(C=C2)C(=O)OCC(C)C

InChI

InChI=1S/C24H27BrN2O6/c1-15(2)13-33-24(31)17-4-7-19(8-5-17)26-22(29)14-32-23(30)11-10-21(28)27-20-9-6-18(25)12-16(20)3/h4-9,12,15H,10-11,13-14H2,1-3H3,(H,26,29)(H,27,28)