2-[(E)-2-(cyclohexen-1-yl)ethenyl]-3-ethyl-1,3-benzothiazol-3-ium

Systemtic Name: 2-[(E)-2-(cyclohexen-1-yl)ethenyl]-3-ethyl-1,3-benzothiazol-3-ium Openeye Name: 2-[(E)-2-(cyclohexen-1-yl)vinyl]-3-ethyl-1,3-benzothiazol-3-ium CAS Name: 2-[(E)-2-(1-cyclohexenyl)ethenyl]-3-ethyl-1,3-benzothiazol-3-ium IUPAC Name: 2-[(E)-2-(cyclohexen-1-yl)ethenyl]-3-ethyl-1,3-benzothiazol-3-ium Traditional Name: 2-[(E)-2-(cyclohexen-1-yl)vinyl]-3-ethyl-1,3-benzothiazol-3-ium Formula: C17H20NS+ MolecularWeight: 270.4124

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=C(SC2=CC=CC=C21)C=CC3=CCCCC3

Isomeric SMILES

CC[N+]1=C(SC2=CC=CC=C21)/C=C/C3=CCCCC3

InChI

InChI=1S/C17H20NS/c1-2-18-15-10-6-7-11-16(15)19-17(18)13-12-14-8-4-3-5-9-14/h6-8,10-13H,2-5,9H2,1H3/q+1/b13-12+