(2,4-dinitrophenyl) 2-(2-oxidanylidene-1,3-benzothiazol-3-yl)ethanoate

Systemtic Name: (2,4-dinitrophenyl) 2-(2-oxidanylidene-1,3-benzothiazol-3-yl)ethanoate Openeye Name: (2,4-dinitrophenyl) 2-(2-oxo-1,3-benzothiazol-3-yl)acetate CAS Name: 2-(2-oxo-1,3-benzothiazol-3-yl)acetic acid (2,4-dinitrophenyl) ester IUPAC Name: (2,4-dinitrophenyl) 2-(2-oxo-1,3-benzothiazol-3-yl)acetate Traditional Name: 2-(2-keto-1,3-benzothiazol-3-yl)acetic acid (2,4-dinitrophenyl) ester Formula: C15H9N3O7S MolecularWeight: 375.31286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N(C(=O)S2)CC(=O)OC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N(C(=O)S2)CC(=O)OC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C15H9N3O7S/c19-14(8-16-10-3-1-2-4-13(10)26-15(16)20)25-12-6-5-9(17(21)22)7-11(12)18(23)24/h1-7H,8H2