[4-[4-[4-(diethylazaniumyl)butanoyl]fluoranthen-8-yl]-4-oxidanylidene-butyl]-diethyl-azanium dichloride

Systemtic Name: [4-[4-[4-(diethylazaniumyl)butanoyl]fluoranthen-8-yl]-4-oxidanylidene-butyl]-diethyl-azanium dichloride Openeye Name: [4-[4-[4-(diethylammonio)butanoyl]fluoranthen-8-yl]-4-oxo-butyl]-diethyl-ammonium dichloride CAS Name: [4-[4-[4-(diethylammonio)-1-oxobutyl]-8-fluoranthenyl]-4-oxobutyl]-diethylammonium dichloride IUPAC Name: [4-[4-[4-(diethylazaniumyl)butanoyl]fluoranthen-8-yl]-4-oxobutyl]-diethylazanium dichloride Traditional Name: [4-[4-[4-(diethylammonio)butanoyl]fluoranthen-8-yl]-4-keto-butyl]-diethyl-ammonium dichloride Formula: C32H42Cl2N2O2 MolecularWeight: 557.59408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCC(=O)C1=CC2=C(C=C1)C3=CC=CC4=C(C=CC2=C43)C(=O)CCC[NH+](CC)CC.[Cl-].[Cl-]

Isomeric SMILES

CC[NH+](CC)CCCC(=O)C1=CC2=C(C=C1)C3=CC=CC4=C(C=CC2=C43)C(=O)CCC[NH+](CC)CC.[Cl-].[Cl-]

InChI

InChI=1S/C32H40N2O2.2ClH/c1-5-33(6-2)20-10-14-30(35)23-16-17-24-26-12-9-13-27-25(18-19-28(32(26)27)29(24)22-23)31(36)15-11-21-34(7-3)8-4;;/h9,12-13,16-19,22H,5-8,10-11,14-15,20-21H2,1-4H3;2*1H