[(3S)-6-bromanyl-3-(dimethylamino)-7-methyl-4-oxidanylidene-2H-chromen-3-yl]methyl-dimethyl-azanium

Systemtic Name: [(3S)-6-bromanyl-3-(dimethylamino)-7-methyl-4-oxidanylidene-2H-chromen-3-yl]methyl-dimethyl-azanium Openeye Name: [(3S)-6-bromo-3-(dimethylamino)-7-methyl-4-oxo-chroman-3-yl]methyl-dimethyl-ammonium CAS Name: [(3S)-6-bromo-3-(dimethylamino)-7-methyl-4-oxo-3,4-dihydro-2H-1-benzopyran-3-yl]methyl-dimethylammonium IUPAC Name: [(3S)-6-bromo-3-(dimethylamino)-7-methyl-4-oxo-2H-chromen-3-yl]methyl-dimethylazanium Traditional Name: [(3S)-6-bromo-3-(dimethylamino)-4-keto-7-methyl-chroman-3-yl]methyl-dimethyl-ammonium Formula: C15H22BrN2O2+ MolecularWeight: 342.25138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)OCC(C2=O)(C[NH+](C)C)N(C)C)Br

Isomeric SMILES

CC1=C(C=C2C(=C1)OC[C@](C2=O)(C[NH+](C)C)N(C)C)Br

InChI

InChI=1S/C15H21BrN2O2/c1-10-6-13-11(7-12(10)16)14(19)15(9-20-13,18(4)5)8-17(2)3/h6-7H,8-9H2,1-5H3/p+1/t15-/m0/s1