3-prop-2-enyl-1,3-benzothiazol-3-ium

Systemtic Name: 3-prop-2-enyl-1,3-benzothiazol-3-ium Openeye Name: 3-allyl-1,3-benzothiazol-3-ium CAS Name: 3-prop-2-enyl-1,3-benzothiazol-3-ium IUPAC Name: 3-prop-2-enyl-1,3-benzothiazol-3-ium Traditional Name: 3-allyl-1,3-benzothiazol-3-ium Formula: C10H10NS+ MolecularWeight: 176.2581

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CC[N+]1=CSC2=CC=CC=C21

Isomeric SMILES

C=CC[N+]1=CSC2=CC=CC=C21

InChI

InChI=1S/C10H10NS/c1-2-7-11-8-12-10-6-4-3-5-9(10)11/h2-6,8H,1,7H2/q+1