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

Systemtic Name: [6-bromanyl-3-[(dimethylazaniumyl)methyl]-4-oxidanylidene-2H-chromen-3-yl]methyl-dimethyl-azanium dichloride Openeye Name: [6-bromo-3-[(dimethylammonio)methyl]-4-oxo-chroman-3-yl]methyl-dimethyl-ammonium dichloride CAS Name: [6-bromo-3-[(dimethylammonio)methyl]-4-oxo-3,4-dihydro-2H-1-benzopyran-3-yl]methyl-dimethylammonium dichloride IUPAC Name: [6-bromo-3-[(dimethylazaniumyl)methyl]-4-oxo-2H-chromen-3-yl]methyl-dimethylazanium dichloride Traditional Name: [6-bromo-3-[(dimethylammonio)methyl]-4-keto-chroman-3-yl]methyl-dimethyl-ammonium dichloride Formula: C15H23BrCl2N2O2 MolecularWeight: 414.16532

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H21BrN2O2.2ClH/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;2*1H