[1-(2-methylpropylamino)-1-oxidanylidene-propan-2-yl] 5-bromanyl-2-oxidanyl-benzoate

Systemtic Name: [1-(2-methylpropylamino)-1-oxidanylidene-propan-2-yl] 5-bromanyl-2-oxidanyl-benzoate Openeye Name: [2-(isobutylamino)-1-methyl-2-oxo-ethyl] 5-bromo-2-hydroxy-benzoate CAS Name: 5-bromo-2-hydroxybenzoic acid [1-(2-methylpropylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2-methylpropylamino)-1-oxopropan-2-yl] 5-bromo-2-hydroxybenzoate Traditional Name: 5-bromo-2-hydroxy-benzoic acid [2-(isobutylamino)-2-keto-1-methyl-ethyl] ester Formula: C14H18BrNO4 MolecularWeight: 344.20102

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C(C)OC(=O)C1=C(C=CC(=C1)Br)O

Isomeric SMILES

CC(C)CNC(=O)C(C)OC(=O)C1=C(C=CC(=C1)Br)O

InChI

InChI=1S/C14H18BrNO4/c1-8(2)7-16-13(18)9(3)20-14(19)11-6-10(15)4-5-12(11)17/h4-6,8-9,17H,7H2,1-3H3,(H,16,18)