6-bromanylhexyl-dimethyl-[3-[5-methyl-1,3-bis(oxidanylidene)isoindol-2-yl]propyl]azanium bromide

Systemtic Name: 6-bromanylhexyl-dimethyl-[3-[5-methyl-1,3-bis(oxidanylidene)isoindol-2-yl]propyl]azanium bromide Openeye Name: 6-bromohexyl-dimethyl-[3-(5-methyl-1,3-dioxo-isoindolin-2-yl)propyl]ammonium bromide CAS Name: 6-bromohexyl-dimethyl-[3-(5-methyl-1,3-dioxo-2-isoindolyl)propyl]ammonium bromide IUPAC Name: 6-bromohexyl-dimethyl-[3-(5-methyl-1,3-dioxoisoindol-2-yl)propyl]azanium bromide Traditional Name: 6-bromohexyl-[3-(1,3-diketo-5-methyl-isoindolin-2-yl)propyl]-dimethyl-ammonium bromide Formula: C20H30Br2N2O2 MolecularWeight: 490.2724

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=O)N(C2=O)CCC[N+](C)(C)CCCCCCBr.[Br-]

Isomeric SMILES

CC1=CC2=C(C=C1)C(=O)N(C2=O)CCC[N+](C)(C)CCCCCCBr.[Br-]

InChI

InChI=1S/C20H30BrN2O2.BrH/c1-16-9-10-17-18(15-16)20(25)22(19(17)24)12-8-14-23(2,3)13-7-5-4-6-11-21;/h9-10,15H,4-8,11-14H2,1-3H3;1H/q+1;/p-1