(3R,4R)-3-bromanyl-2,2-dimethyl-4-oxidanyl-3,4-dihydrochromene-6-carbonitrile

Systemtic Name: (3R,4R)-3-bromanyl-2,2-dimethyl-4-oxidanyl-3,4-dihydrochromene-6-carbonitrile Openeye Name: (3R,4R)-3-bromo-4-hydroxy-2,2-dimethyl-chromane-6-carbonitrile CAS Name: (3R,4R)-3-bromo-4-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-6-carbonitrile IUPAC Name: (3R,4R)-3-bromo-4-hydroxy-2,2-dimethyl-3,4-dihydrochromene-6-carbonitrile Traditional Name: (3R,4R)-3-bromo-4-hydroxy-2,2-dimethyl-chroman-6-carbonitrile Formula: C12H12BrNO2 MolecularWeight: 282.13318

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)O)Br)C

Isomeric SMILES

CC1([C@@H]([C@@H](C2=C(O1)C=CC(=C2)C#N)O)Br)C

InChI

InChI=1S/C12H12BrNO2/c1-12(2)11(13)10(15)8-5-7(6-14)3-4-9(8)16-12/h3-5,10-11,15H,1-2H3/t10-,11-/m1/s1