N-(4-oxidanylidenechromen-3-yl)-2-[1,1,3-tris(oxidanylidene)-2H-1,3-benzothiazol-3-ium-2-yl]ethanamide

Systemtic Name: N-(4-oxidanylidenechromen-3-yl)-2-[1,1,3-tris(oxidanylidene)-2H-1,3-benzothiazol-3-ium-2-yl]ethanamide Openeye Name: N-(4-oxochromen-3-yl)-2-(1,1,3-trioxo-2H-1,3-benzothiazol-3-ium-2-yl)acetamide CAS Name: N-(4-oxo-1-benzopyran-3-yl)-2-(1,1,3-trioxo-2H-1,3-benzothiazol-3-ium-2-yl)acetamide IUPAC Name: N-(4-oxochromen-3-yl)-2-(1,1,3-trioxo-2H-1,3-benzothiazol-3-ium-2-yl)acetamide Traditional Name: N-(4-ketochromen-3-yl)-2-(1,1,3-triketo-2H-1,3-benzothiazol-3-ium-2-yl)acetamide Formula: C18H13N2O6S+ MolecularWeight: 385.37062

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C(=CO2)NC(=O)CC3[N+](=O)C4=CC=CC=C4S3(=O)=O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C(=CO2)NC(=O)CC3[N+](=O)C4=CC=CC=C4S3(=O)=O

InChI

InChI=1S/C18H12N2O6S/c21-16(19-12-10-26-14-7-3-1-5-11(14)18(12)22)9-17-20(23)13-6-2-4-8-15(13)27(17,24)25/h1-8,10,17H,9H2/p+1