N-(3-morpholin-4-ylsulfonylphenyl)-2-(6-nitro-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanamide

Systemtic Name: N-(3-morpholin-4-ylsulfonylphenyl)-2-(6-nitro-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanamide Openeye Name: N-(3-morpholinosulfonylphenyl)-2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)acetamide CAS Name: N-[3-(4-morpholinylsulfonyl)phenyl]-2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)acetamide IUPAC Name: N-(3-morpholin-4-ylsulfonylphenyl)-2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)acetamide Traditional Name: 2-(3-keto-6-nitro-1,4-benzoxazin-4-yl)-N-(3-morpholinosulfonylphenyl)acetamide Formula: C20H20N4O8S MolecularWeight: 476.4598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)NC(=O)CN3C(=O)COC4=C3C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)NC(=O)CN3C(=O)COC4=C3C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H20N4O8S/c25-19(12-23-17-11-15(24(27)28)4-5-18(17)32-13-20(23)26)21-14-2-1-3-16(10-14)33(29,30)22-6-8-31-9-7-22/h1-5,10-11H,6-9,12-13H2,(H,21,25)