4-[9-[4-(diethylazaniumyl)but-2-ynyl]fluoren-9-yl]but-2-ynyl-diethyl-azanium dichloride

Systemtic Name: 4-[9-[4-(diethylazaniumyl)but-2-ynyl]fluoren-9-yl]but-2-ynyl-diethyl-azanium dichloride Openeye Name: 4-[9-[4-(diethylammonio)but-2-ynyl]fluoren-9-yl]but-2-ynyl-diethyl-ammonium dichloride CAS Name: 4-[9-[4-(diethylammonio)but-2-ynyl]-9-fluorenyl]but-2-ynyl-diethylammonium dichloride IUPAC Name: 4-[9-[4-(diethylazaniumyl)but-2-ynyl]fluoren-9-yl]but-2-ynyl-diethylazanium dichloride Traditional Name: 4-[9-[4-(diethylammonio)but-2-ynyl]fluoren-9-yl]but-2-ynyl-diethyl-ammonium dichloride Formula: C29H38Cl2N2 MolecularWeight: 485.53142

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC#CCC1(C2=CC=CC=C2C3=CC=CC=C31)CC#CC[NH+](CC)CC.[Cl-].[Cl-]

Isomeric SMILES

CC[NH+](CC)CC#CCC1(C2=CC=CC=C2C3=CC=CC=C31)CC#CC[NH+](CC)CC.[Cl-].[Cl-]

InChI

InChI=1S/C29H36N2.2ClH/c1-5-30(6-2)23-15-13-21-29(22-14-16-24-31(7-3)8-4)27-19-11-9-17-25(27)26-18-10-12-20-28(26)29;;/h9-12,17-20H,5-8,21-24H2,1-4H3;2*1H