[(E)-2-(1-ethylbenzo[e][1,3]benzothiazol-1-ium-2-yl)ethenyl]-dimethyl-azanium

Systemtic Name: [(E)-2-(1-ethylbenzo[e][1,3]benzothiazol-1-ium-2-yl)ethenyl]-dimethyl-azanium Openeye Name: [(E)-2-(1-ethylbenzo[e][1,3]benzothiazol-1-ium-2-yl)vinyl]-dimethyl-ammonium CAS Name: [(E)-2-(1-ethyl-2-benzo[e][1,3]benzothiazol-1-iumyl)ethenyl]-dimethylammonium IUPAC Name: [(E)-2-(1-ethylbenzo[e][1,3]benzothiazol-1-ium-2-yl)ethenyl]-dimethylazanium Traditional Name: [(E)-2-(1-ethylbenzo[e][1,3]benzothiazol-1-ium-2-yl)vinyl]-dimethyl-ammonium Formula: C17H20N2S+2 MolecularWeight: 284.4191

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=C(SC2=C1C3=CC=CC=C3C=C2)C=C[NH+](C)C

Isomeric SMILES

CC[N+]1=C(SC2=C1C3=CC=CC=C3C=C2)/C=C/[NH+](C)C

InChI

InChI=1S/C17H19N2S/c1-4-19-16(11-12-18(2)3)20-15-10-9-13-7-5-6-8-14(13)17(15)19/h5-12H,4H2,1-3H3/q+1/p+1