N-[2-(2-acetamido-4-nitro-phenyl)sulfinyl-5-nitro-phenyl]ethanamide

Systemtic Name: N-[2-(2-acetamido-4-nitro-phenyl)sulfinyl-5-nitro-phenyl]ethanamide Openeye Name: N-[2-(2-acetamido-4-nitro-phenyl)sulfinyl-5-nitro-phenyl]acetamide CAS Name: N-[2-(2-acetamido-4-nitrophenyl)sulfinyl-5-nitrophenyl]acetamide IUPAC Name: N-[2-(2-acetamido-4-nitrophenyl)sulfinyl-5-nitrophenyl]acetamide Traditional Name: N-[2-(2-acetamido-4-nitro-phenyl)sulfinyl-5-nitro-phenyl]acetamide Formula: C16H14N4O7S MolecularWeight: 406.36996

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])S(=O)C2=C(C=C(C=C2)[N+](=O)[O-])NC(=O)C

Isomeric SMILES

CC(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])S(=O)C2=C(C=C(C=C2)[N+](=O)[O-])NC(=O)C

InChI

InChI=1S/C16H14N4O7S/c1-9(21)17-13-7-11(19(23)24)3-5-15(13)28(27)16-6-4-12(20(25)26)8-14(16)18-10(2)22/h3-8H,1-2H3,(H,17,21)(H,18,22)