[2-(butylamino)-2-oxidanylidene-ethyl] 5-bromanyl-2-oxidanyl-benzoate

Systemtic Name: [2-(butylamino)-2-oxidanylidene-ethyl] 5-bromanyl-2-oxidanyl-benzoate Openeye Name: [2-(butylamino)-2-oxo-ethyl] 5-bromo-2-hydroxy-benzoate CAS Name: 5-bromo-2-hydroxybenzoic acid [2-(butylamino)-2-oxoethyl] ester IUPAC Name: [2-(butylamino)-2-oxoethyl] 5-bromo-2-hydroxybenzoate Traditional Name: 5-bromo-2-hydroxy-benzoic acid [2-(butylamino)-2-keto-ethyl] ester Formula: C13H16BrNO4 MolecularWeight: 330.17444

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)COC(=O)C1=C(C=CC(=C1)Br)O

Isomeric SMILES

CCCCNC(=O)COC(=O)C1=C(C=CC(=C1)Br)O

InChI

InChI=1S/C13H16BrNO4/c1-2-3-6-15-12(17)8-19-13(18)10-7-9(14)4-5-11(10)16/h4-5,7,16H,2-3,6,8H2,1H3,(H,15,17)