3-[5,11-bis(oxidanylidene)indeno[1,2-c]isoquinolin-6-yl]propyl-triethyl-azanium bromide

Systemtic Name: 3-[5,11-bis(oxidanylidene)indeno[1,2-c]isoquinolin-6-yl]propyl-triethyl-azanium bromide Openeye Name: 3-(5,11-dioxoindeno[1,2-c]isoquinolin-6-yl)propyl-triethyl-ammonium bromide CAS Name: 3-(5,11-dioxo-6-indeno[1,2-c]isoquinolinyl)propyl-triethylammonium bromide IUPAC Name: 3-(5,11-dioxoindeno[1,2-c]isoquinolin-6-yl)propyl-triethylazanium bromide Traditional Name: 3-(5,11-diketoinden[1,2-c]isoquinolin-6-yl)propyl-triethyl-ammonium bromide Formula: C25H29BrN2O2 MolecularWeight: 469.41396

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](CC)(CC)CCCN1C2=C(C3=CC=CC=C3C1=O)C(=O)C4=CC=CC=C42.[Br-]

Isomeric SMILES

CC[N+](CC)(CC)CCCN1C2=C(C3=CC=CC=C3C1=O)C(=O)C4=CC=CC=C42.[Br-]

InChI

InChI=1S/C25H29N2O2.BrH/c1-4-27(5-2,6-3)17-11-16-26-23-19-13-8-9-14-20(19)24(28)22(23)18-12-7-10-15-21(18)25(26)29;/h7-10,12-15H,4-6,11,16-17H2,1-3H3;1H/q+1;/p-1