[2-oxidanylidene-2-[(2-propan-2-ylphenyl)amino]ethyl] 4-(4-bromanyl-2-chloranyl-phenoxy)butanoate

Systemtic Name: [2-oxidanylidene-2-[(2-propan-2-ylphenyl)amino]ethyl] 4-(4-bromanyl-2-chloranyl-phenoxy)butanoate Openeye Name: [2-(2-isopropylanilino)-2-oxo-ethyl] 4-(4-bromo-2-chloro-phenoxy)butanoate CAS Name: 4-(4-bromo-2-chlorophenoxy)butanoic acid [2-oxo-2-(2-propan-2-ylanilino)ethyl] ester IUPAC Name: [2-oxo-2-(2-propan-2-ylanilino)ethyl] 4-(4-bromo-2-chlorophenoxy)butanoate Traditional Name: 4-(4-bromo-2-chloro-phenoxy)butyric acid [2-(2-isopropylanilino)-2-keto-ethyl] ester Formula: C21H23BrClNO4 MolecularWeight: 468.76862

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1NC(=O)COC(=O)CCCOC2=C(C=C(C=C2)Br)Cl

Isomeric SMILES

CC(C)C1=CC=CC=C1NC(=O)COC(=O)CCCOC2=C(C=C(C=C2)Br)Cl

InChI

InChI=1S/C21H23BrClNO4/c1-14(2)16-6-3-4-7-18(16)24-20(25)13-28-21(26)8-5-11-27-19-10-9-15(22)12-17(19)23/h3-4,6-7,9-10,12,14H,5,8,11,13H2,1-2H3,(H,24,25)