2-[(3S,4aS)-5-bromanyl-8-methoxy-9-oxidanyl-1-oxidanylidene-2,3,4,4a-tetrahydrofluoren-3-yl]ethanoate

Systemtic Name: 2-[(3S,4aS)-5-bromanyl-8-methoxy-9-oxidanyl-1-oxidanylidene-2,3,4,4a-tetrahydrofluoren-3-yl]ethanoate Openeye Name: 2-[(3S,4aS)-5-bromo-9-hydroxy-8-methoxy-1-oxo-2,3,4,4a-tetrahydrofluoren-3-yl]acetate CAS Name: 2-[(3S,4aS)-5-bromo-9-hydroxy-8-methoxy-1-oxo-2,3,4,4a-tetrahydrofluoren-3-yl]acetate IUPAC Name: 2-[(3S,4aS)-5-bromo-9-hydroxy-8-methoxy-1-oxo-2,3,4,4a-tetrahydrofluoren-3-yl]acetate Traditional Name: 2-[(3S,4aS)-5-bromo-9-hydroxy-1-keto-8-methoxy-2,3,4,4a-tetrahydrofluoren-3-yl]acetate Formula: C16H14BrO5- MolecularWeight: 366.18336

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=C(C=C1)Br)C3CC(CC(=O)C3=C2O)CC(=O)[O-]

Isomeric SMILES

COC1=C2C(=C(C=C1)Br)[C@H]3C[C@@H](CC(=O)C3=C2O)CC(=O)[O-]

InChI

InChI=1S/C16H15BrO5/c1-22-11-3-2-9(17)13-8-4-7(6-12(19)20)5-10(18)14(8)16(21)15(11)13/h2-3,7-8,21H,4-6H2,1H3,(H,19,20)/p-1/t7-,8+/m0/s1