[2-(2-methylpropylamino)-2-oxidanylidene-ethyl] 5-bromanyl-2-chloranyl-benzoate

Systemtic Name: [2-(2-methylpropylamino)-2-oxidanylidene-ethyl] 5-bromanyl-2-chloranyl-benzoate Openeye Name: [2-(isobutylamino)-2-oxo-ethyl] 5-bromo-2-chloro-benzoate CAS Name: 5-bromo-2-chlorobenzoic acid [2-(2-methylpropylamino)-2-oxoethyl] ester IUPAC Name: [2-(2-methylpropylamino)-2-oxoethyl] 5-bromo-2-chlorobenzoate Traditional Name: 5-bromo-2-chloro-benzoic acid [2-(isobutylamino)-2-keto-ethyl] ester Formula: C13H15BrClNO3 MolecularWeight: 348.6201

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)COC(=O)C1=C(C=CC(=C1)Br)Cl

Isomeric SMILES

CC(C)CNC(=O)COC(=O)C1=C(C=CC(=C1)Br)Cl

InChI

InChI=1S/C13H15BrClNO3/c1-8(2)6-16-12(17)7-19-13(18)10-5-9(14)3-4-11(10)15/h3-5,8H,6-7H2,1-2H3,(H,16,17)