5-bromanyl-2-[2-(butan-2-ylamino)-2-oxidanylidene-ethoxy]benzoic acid

Systemtic Name: 5-bromanyl-2-[2-(butan-2-ylamino)-2-oxidanylidene-ethoxy]benzoic acid Openeye Name: 5-bromo-2-[2-oxo-2-(sec-butylamino)ethoxy]benzoic acid CAS Name: 5-bromo-2-[2-(butan-2-ylamino)-2-oxoethoxy]benzoic acid IUPAC Name: 5-bromo-2-[2-(butan-2-ylamino)-2-oxoethoxy]benzoic acid Traditional Name: 5-bromo-2-[2-keto-2-(sec-butylamino)ethoxy]benzoic acid Formula: C13H16BrNO4 MolecularWeight: 330.17444

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)COC1=C(C=C(C=C1)Br)C(=O)O

Isomeric SMILES

CCC(C)NC(=O)COC1=C(C=C(C=C1)Br)C(=O)O

InChI

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