2-(2-azanyl-6-methoxy-1,3-benzothiazol-3-ium-3-yl)-1-phenyl-ethanone

Systemtic Name: 2-(2-azanyl-6-methoxy-1,3-benzothiazol-3-ium-3-yl)-1-phenyl-ethanone Openeye Name: 2-(2-amino-6-methoxy-1,3-benzothiazol-3-ium-3-yl)-1-phenyl-ethanone CAS Name: 2-(2-amino-6-methoxy-1,3-benzothiazol-3-ium-3-yl)-1-phenylethanone IUPAC Name: 2-(2-amino-6-methoxy-1,3-benzothiazol-3-ium-3-yl)-1-phenylethanone Traditional Name: 2-(2-amino-6-methoxy-1,3-benzothiazol-3-ium-3-yl)-1-phenyl-ethanone Formula: C16H15N2O2S+ MolecularWeight: 299.3675

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)[N+](=C(S2)N)CC(=O)C3=CC=CC=C3

Isomeric SMILES

COC1=CC2=C(C=C1)[N+](=C(S2)N)CC(=O)C3=CC=CC=C3

InChI

InChI=1S/C16H14N2O2S/c1-20-12-7-8-13-15(9-12)21-16(17)18(13)10-14(19)11-5-3-2-4-6-11/h2-9,17H,10H2,1H3/p+1