4-(8,8-dimethyl-4,8-diazoniaspiro[4.5]decan-2-yl)benzene-1,2-diol dibromide

Systemtic Name: 4-(8,8-dimethyl-4,8-diazoniaspiro[4.5]decan-2-yl)benzene-1,2-diol dibromide Openeye Name: 4-(8,8-dimethyl-4,8-diazoniaspiro[4.5]decan-2-yl)benzene-1,2-diol dibromide CAS Name: 4-(8,8-dimethyl-4,8-diazoniaspiro[4.5]decan-2-yl)benzene-1,2-diol dibromide IUPAC Name: 4-(8,8-dimethyl-4,8-diazoniaspiro[4.5]decan-2-yl)benzene-1,2-diol dibromide Traditional Name: 4-(8,8-dimethyl-4,8-diazoniaspiro[4.5]decan-2-yl)pyrocatechol dibromide Formula: C16H26Br2N2O2 MolecularWeight: 438.19784

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCC2(CC1)CC(C[NH2+]2)C3=CC(=C(C=C3)O)O)C.[Br-].[Br-]

Isomeric SMILES

C[N+]1(CCC2(CC1)CC(C[NH2+]2)C3=CC(=C(C=C3)O)O)C.[Br-].[Br-]

InChI

InChI=1S/C16H24N2O2.2BrH/c1-18(2)7-5-16(6-8-18)10-13(11-17-16)12-3-4-14(19)15(20)9-12;;/h3-4,9,13,17H,5-8,10-11H2,1-2H3,(H-,19,20);2*1H