3-bromanyl-4-(3,4-diacetyloxyphenyl)-4-oxidanylidene-butanoate

Systemtic Name: 3-bromanyl-4-(3,4-diacetyloxyphenyl)-4-oxidanylidene-butanoate Openeye Name: 3-bromo-4-(3,4-diacetoxyphenyl)-4-oxo-butanoate CAS Name: 3-bromo-4-(3,4-diacetyloxyphenyl)-4-oxobutanoate IUPAC Name: 3-bromo-4-(3,4-diacetyloxyphenyl)-4-oxobutanoate Traditional Name: 3-bromo-4-(3,4-diacetoxyphenyl)-4-keto-butyrate Formula: C14H12BrO7- MolecularWeight: 372.14488

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C(C=C1)C(=O)C(CC(=O)[O-])Br)OC(=O)C

Isomeric SMILES

CC(=O)OC1=C(C=C(C=C1)C(=O)C(CC(=O)[O-])Br)OC(=O)C

InChI

InChI=1S/C14H13BrO7/c1-7(16)21-11-4-3-9(5-12(11)22-8(2)17)14(20)10(15)6-13(18)19/h3-5,10H,6H2,1-2H3,(H,18,19)/p-1