ethyl-[3-(2-ethyl-1,3-dihydrobenzo[de]isoquinolin-2-ium-2-yl)propyl]-dimethyl-azanium

Systemtic Name: ethyl-[3-(2-ethyl-1,3-dihydrobenzo[de]isoquinolin-2-ium-2-yl)propyl]-dimethyl-azanium Openeye Name: ethyl-[3-(2-ethyl-1,3-dihydrobenzo[de]isoquinolin-2-ium-2-yl)propyl]-dimethyl-ammonium CAS Name: ethyl-[3-(2-ethyl-1,3-dihydrobenzo[de]isoquinolin-2-ium-2-yl)propyl]-dimethylammonium IUPAC Name: ethyl-[3-(2-ethyl-1,3-dihydrobenzo[de]isoquinolin-2-ium-2-yl)propyl]-dimethylazanium Traditional Name: ethyl-[3-(2-ethyl-1,3-dihydrobenzo[de]isoquinolin-2-ium-2-yl)propyl]-dimethyl-ammonium Formula: C21H32N2+2 MolecularWeight: 312.49218

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1(CC2=CC=CC3=C2C(=CC=C3)C1)CCC[N+](C)(C)CC

Isomeric SMILES

CC[N+]1(CC2=CC=CC3=C2C(=CC=C3)C1)CCC[N+](C)(C)CC

InChI

InChI=1S/C21H32N2/c1-5-22(3,4)14-9-15-23(6-2)16-19-12-7-10-18-11-8-13-20(17-23)21(18)19/h7-8,10-13H,5-6,9,14-17H2,1-4H3/q+2