N-[2-(4-chlorophenyl)sulfanylethyl]-2-(4-methanoyl-2-nitro-phenoxy)ethanamide

Systemtic Name: N-[2-(4-chlorophenyl)sulfanylethyl]-2-(4-methanoyl-2-nitro-phenoxy)ethanamide Openeye Name: N-[2-(4-chlorophenyl)sulfanylethyl]-2-(4-formyl-2-nitro-phenoxy)acetamide CAS Name: N-[2-[(4-chlorophenyl)thio]ethyl]-2-(4-formyl-2-nitrophenoxy)acetamide IUPAC Name: N-[2-(4-chlorophenyl)sulfanylethyl]-2-(4-formyl-2-nitrophenoxy)acetamide Traditional Name: N-[2-[(4-chlorophenyl)thio]ethyl]-2-(4-formyl-2-nitro-phenoxy)acetamide Formula: C17H15ClN2O5S MolecularWeight: 394.8294

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1SCCNC(=O)COC2=C(C=C(C=C2)C=O)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=CC=C1SCCNC(=O)COC2=C(C=C(C=C2)C=O)[N+](=O)[O-])Cl

InChI

InChI=1S/C17H15ClN2O5S/c18-13-2-4-14(5-3-13)26-8-7-19-17(22)11-25-16-6-1-12(10-21)9-15(16)20(23)24/h1-6,9-10H,7-8,11H2,(H,19,22)