[(1R)-3,5-bis(bromanyl)-1-(cyanomethyl)-4-methoxy-6-oxidanylidene-cyclohexa-2,4-dien-1-yl] ethanoate

Systemtic Name: [(1R)-3,5-bis(bromanyl)-1-(cyanomethyl)-4-methoxy-6-oxidanylidene-cyclohexa-2,4-dien-1-yl] ethanoate Openeye Name: [(1R)-3,5-dibromo-1-(cyanomethyl)-4-methoxy-6-oxo-cyclohexa-2,4-dien-1-yl] acetate CAS Name: acetic acid [(1R)-3,5-dibromo-1-(cyanomethyl)-4-methoxy-6-oxo-1-cyclohexa-2,4-dienyl] ester IUPAC Name: [(1R)-3,5-dibromo-1-(cyanomethyl)-4-methoxy-6-oxocyclohexa-2,4-dien-1-yl] acetate Traditional Name: acetic acid [(1R)-3,5-dibromo-1-(cyanomethyl)-6-keto-4-methoxy-cyclohexa-2,4-dien-1-yl] ester Formula: C11H9Br2NO4 MolecularWeight: 379.00146

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1(C=C(C(=C(C1=O)Br)OC)Br)CC#N

Isomeric SMILES

CC(=O)O[C@@]1(C=C(C(=C(C1=O)Br)OC)Br)CC#N

InChI

InChI=1S/C11H9Br2NO4/c1-6(15)18-11(3-4-14)5-7(12)9(17-2)8(13)10(11)16/h5H,3H2,1-2H3/t11-/m1/s1