3-bromanyl-2,2,3-trimethyl-4-oxidanyl-4H-chromene-6-carbonitrile

Systemtic Name: 3-bromanyl-2,2,3-trimethyl-4-oxidanyl-4H-chromene-6-carbonitrile Openeye Name: 3-bromo-4-hydroxy-2,2,3-trimethyl-chromane-6-carbonitrile CAS Name: 3-bromo-4-hydroxy-2,2,3-trimethyl-3,4-dihydro-2H-1-benzopyran-6-carbonitrile IUPAC Name: 3-bromo-4-hydroxy-2,2,3-trimethyl-4H-chromene-6-carbonitrile Traditional Name: 3-bromo-4-hydroxy-2,2,3-trimethyl-chroman-6-carbonitrile Formula: C13H14BrNO2 MolecularWeight: 296.15976

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14BrNO2/c1-12(2)13(3,14)11(16)9-6-8(7-15)4-5-10(9)17-12/h4-6,11,16H,1-3H3