2-(2-cyanophenoxy)-N-[2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethyl]ethanamide

Systemtic Name: 2-(2-cyanophenoxy)-N-[2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethyl]ethanamide Openeye Name: 2-(2-cyanophenoxy)-N-[2-(4-methylsulfonyl-2-nitro-anilino)ethyl]acetamide CAS Name: 2-(2-cyanophenoxy)-N-[2-(4-methylsulfonyl-2-nitroanilino)ethyl]acetamide IUPAC Name: 2-(2-cyanophenoxy)-N-[2-(4-methylsulfonyl-2-nitroanilino)ethyl]acetamide Traditional Name: 2-(2-cyanophenoxy)-N-[2-(4-mesyl-2-nitro-anilino)ethyl]acetamide Formula: C18H18N4O6S MolecularWeight: 418.42372

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)NCCNC(=O)COC2=CC=CC=C2C#N)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)NCCNC(=O)COC2=CC=CC=C2C#N)[N+](=O)[O-]

InChI

InChI=1S/C18H18N4O6S/c1-29(26,27)14-6-7-15(16(10-14)22(24)25)20-8-9-21-18(23)12-28-17-5-3-2-4-13(17)11-19/h2-7,10,20H,8-9,12H2,1H3,(H,21,23)