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

Systemtic Name: [6-bromanyl-3-[(dimethylazaniumyl)methyl]-4-oxidanylidene-2H-chromen-3-yl]methyl-dimethyl-azanium Openeye Name: [6-bromo-3-[(dimethylammonio)methyl]-4-oxo-chroman-3-yl]methyl-dimethyl-ammonium CAS Name: [6-bromo-3-[(dimethylammonio)methyl]-4-oxo-3,4-dihydro-2H-1-benzopyran-3-yl]methyl-dimethylammonium IUPAC Name: [6-bromo-3-[(dimethylazaniumyl)methyl]-4-oxo-2H-chromen-3-yl]methyl-dimethylazanium Traditional Name: [6-bromo-3-[(dimethylammonio)methyl]-4-keto-chroman-3-yl]methyl-dimethyl-ammonium Formula: C15H23BrN2O2+2 MolecularWeight: 343.25932

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC1(COC2=C(C1=O)C=C(C=C2)Br)C[NH+](C)C

Isomeric SMILES

C[NH+](C)CC1(COC2=C(C1=O)C=C(C=C2)Br)C[NH+](C)C

InChI

InChI=1S/C15H21BrN2O2/c1-17(2)8-15(9-18(3)4)10-20-13-6-5-11(16)7-12(13)14(15)19/h5-7H,8-10H2,1-4H3/p+2