2-[(7-oxidanylidenecyclohepta-1,3,5-trien-1-yl)azaniumyl]ethyl-di(propan-2-yl)azanium dichloride

Systemtic Name: 2-[(7-oxidanylidenecyclohepta-1,3,5-trien-1-yl)azaniumyl]ethyl-di(propan-2-yl)azanium dichloride Openeye Name: diisopropyl-[2-[(7-oxocyclohepta-1,3,5-trien-1-yl)ammonio]ethyl]ammonium dichloride CAS Name: 2-[(7-oxo-1-cyclohepta-1,3,5-trienyl)ammonio]ethyl-di(propan-2-yl)ammonium dichloride IUPAC Name: 2-[(7-oxocyclohepta-1,3,5-trien-1-yl)azaniumyl]ethyl-di(propan-2-yl)azanium dichloride Traditional Name: diisopropyl-[2-[(7-ketocyclohepta-1,3,5-trien-1-yl)ammonio]ethyl]ammonium dichloride Formula: C15H26Cl2N2O MolecularWeight: 321.28574

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+](CC[NH2+]C1=CC=CC=CC1=O)C(C)C.[Cl-].[Cl-]

Isomeric SMILES

CC(C)[NH+](CC[NH2+]C1=CC=CC=CC1=O)C(C)C.[Cl-].[Cl-]

InChI

InChI=1S/C15H24N2O.2ClH/c1-12(2)17(13(3)4)11-10-16-14-8-6-5-7-9-15(14)18;;/h5-9,12-13H,10-11H2,1-4H3,(H,16,18);2*1H