[(3S)-6,8-bis(bromanyl)-7-methyl-4-oxidanylidene-2,3-dihydrochromen-3-yl]-diethyl-azanium

Systemtic Name: [(3S)-6,8-bis(bromanyl)-7-methyl-4-oxidanylidene-2,3-dihydrochromen-3-yl]-diethyl-azanium Openeye Name: [(3S)-6,8-dibromo-7-methyl-4-oxo-chroman-3-yl]-diethyl-ammonium CAS Name: [(3S)-6,8-dibromo-7-methyl-4-oxo-3,4-dihydro-2H-1-benzopyran-3-yl]-diethylammonium IUPAC Name: [(3S)-6,8-dibromo-7-methyl-4-oxo-2,3-dihydrochromen-3-yl]-diethylazanium Traditional Name: [(3S)-6,8-dibromo-4-keto-7-methyl-chroman-3-yl]-diethyl-ammonium Formula: C14H18Br2NO2+ MolecularWeight: 392.10622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)C1COC2=C(C(=C(C=C2C1=O)Br)C)Br

Isomeric SMILES

CC[NH+](CC)[C@H]1COC2=C(C(=C(C=C2C1=O)Br)C)Br

InChI

InChI=1S/C14H17Br2NO2/c1-4-17(5-2)11-7-19-14-9(13(11)18)6-10(15)8(3)12(14)16/h6,11H,4-5,7H2,1-3H3/p+1/t11-/m0/s1