2-[(3-bromanyl-4-oxidanylidene-2,3-dihydrochromen-8-yl)oxy]butanoate

Systemtic Name: 2-[(3-bromanyl-4-oxidanylidene-2,3-dihydrochromen-8-yl)oxy]butanoate Openeye Name: 2-(3-bromo-4-oxo-chroman-8-yl)oxybutanoate CAS Name: 2-[(3-bromo-4-oxo-3,4-dihydro-2H-1-benzopyran-8-yl)oxy]butanoate IUPAC Name: 2-[(3-bromo-4-oxo-2,3-dihydrochromen-8-yl)oxy]butanoate Traditional Name: 2-(3-bromo-4-keto-chroman-8-yl)oxybutyrate Formula: C13H12BrO5- MolecularWeight: 328.13538

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)[O-])OC1=CC=CC2=C1OCC(C2=O)Br

Isomeric SMILES

CCC(C(=O)[O-])OC1=CC=CC2=C1OCC(C2=O)Br

InChI

InChI=1S/C13H13BrO5/c1-2-9(13(16)17)19-10-5-3-4-7-11(15)8(14)6-18-12(7)10/h3-5,8-9H,2,6H2,1H3,(H,16,17)/p-1