3-(2,3-dihydro-1,3-benzothiazol-2-yl)propyl-triethyl-azanium

Systemtic Name: 3-(2,3-dihydro-1,3-benzothiazol-2-yl)propyl-triethyl-azanium Openeye Name: 3-(2,3-dihydro-1,3-benzothiazol-2-yl)propyl-triethyl-ammonium CAS Name: 3-(2,3-dihydro-1,3-benzothiazol-2-yl)propyl-triethylammonium IUPAC Name: 3-(2,3-dihydro-1,3-benzothiazol-2-yl)propyl-triethylazanium Traditional Name: 3-(2,3-dihydro-1,3-benzothiazol-2-yl)propyl-triethyl-ammonium Formula: C16H27N2S+ MolecularWeight: 279.46398

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](CC)(CC)CCCC1NC2=CC=CC=C2S1

Isomeric SMILES

CC[N+](CC)(CC)CCCC1NC2=CC=CC=C2S1

InChI

InChI=1S/C16H27N2S/c1-4-18(5-2,6-3)13-9-12-16-17-14-10-7-8-11-15(14)19-16/h7-8,10-11,16-17H,4-6,9,12-13H2,1-3H3/q+1