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

Systemtic Name: [(3S)-6-bromanyl-7,8-dimethyl-4-oxidanylidene-2,3-dihydrochromen-3-yl]-diethyl-azanium Openeye Name: [(3S)-6-bromo-7,8-dimethyl-4-oxo-chroman-3-yl]-diethyl-ammonium CAS Name: [(3S)-6-bromo-7,8-dimethyl-4-oxo-3,4-dihydro-2H-1-benzopyran-3-yl]-diethylammonium IUPAC Name: [(3S)-6-bromo-7,8-dimethyl-4-oxo-2,3-dihydrochromen-3-yl]-diethylazanium Traditional Name: [(3S)-6-bromo-4-keto-7,8-dimethyl-chroman-3-yl]-diethyl-ammonium Formula: C15H21BrNO2+ MolecularWeight: 327.23674

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H20BrNO2/c1-5-17(6-2)13-8-19-15-10(4)9(3)12(16)7-11(15)14(13)18/h7,13H,5-6,8H2,1-4H3/p+1/t13-/m0/s1