3-ethyl-2-methyl-6-prop-2-enoxy-1,3-benzothiazol-3-ium

Systemtic Name: 3-ethyl-2-methyl-6-prop-2-enoxy-1,3-benzothiazol-3-ium Openeye Name: 6-allyloxy-3-ethyl-2-methyl-1,3-benzothiazol-3-ium CAS Name: 3-ethyl-2-methyl-6-prop-2-enoxy-1,3-benzothiazol-3-ium IUPAC Name: 3-ethyl-2-methyl-6-prop-2-enoxy-1,3-benzothiazol-3-ium Traditional Name: 6-allyloxy-3-ethyl-2-methyl-1,3-benzothiazol-3-ium Formula: C13H16NOS+ MolecularWeight: 234.33724

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=C(SC2=C1C=CC(=C2)OCC=C)C

Isomeric SMILES

CC[N+]1=C(SC2=C1C=CC(=C2)OCC=C)C

InChI

InChI=1S/C13H16NOS/c1-4-8-15-11-6-7-12-13(9-11)16-10(3)14(12)5-2/h4,6-7,9H,1,5,8H2,2-3H3/q+1