2-[4-(4-nitrophenyl)sulfonylphenyl]-1,2-benzothiazol-3-one

Systemtic Name: 2-[4-(4-nitrophenyl)sulfonylphenyl]-1,2-benzothiazol-3-one Openeye Name: 2-[4-(4-nitrophenyl)sulfonylphenyl]-1,2-benzothiazol-3-one CAS Name: 2-[4-(4-nitrophenyl)sulfonylphenyl]-1,2-benzothiazol-3-one IUPAC Name: 2-[4-(4-nitrophenyl)sulfonylphenyl]-1,2-benzothiazol-3-one Traditional Name: 2-(4-nosylphenyl)-1,2-benzothiazol-3-one Formula: C19H12N2O5S2 MolecularWeight: 412.43898

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(S2)C3=CC=C(C=C3)S(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(S2)C3=CC=C(C=C3)S(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H12N2O5S2/c22-19-17-3-1-2-4-18(17)27-20(19)13-5-9-15(10-6-13)28(25,26)16-11-7-14(8-12-16)21(23)24/h1-12H