5-bromanyl-2-[2-(2-methylpropylamino)-2-oxidanylidene-ethoxy]benzoate

Systemtic Name: 5-bromanyl-2-[2-(2-methylpropylamino)-2-oxidanylidene-ethoxy]benzoate Openeye Name: 5-bromo-2-[2-(isobutylamino)-2-oxo-ethoxy]benzoate CAS Name: 5-bromo-2-[2-(2-methylpropylamino)-2-oxoethoxy]benzoate IUPAC Name: 5-bromo-2-[2-(2-methylpropylamino)-2-oxoethoxy]benzoate Traditional Name: 5-bromo-2-[2-(isobutylamino)-2-keto-ethoxy]benzoate Formula: C13H15BrNO4- MolecularWeight: 329.1665

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)COC1=C(C=C(C=C1)Br)C(=O)[O-]

Isomeric SMILES

CC(C)CNC(=O)COC1=C(C=C(C=C1)Br)C(=O)[O-]

InChI

InChI=1S/C13H16BrNO4/c1-8(2)6-15-12(16)7-19-11-4-3-9(14)5-10(11)13(17)18/h3-5,8H,6-7H2,1-2H3,(H,15,16)(H,17,18)/p-1