N-[2-(2-azanyl-2-oxidanylidene-ethyl)sulfanylphenyl]-2-(4-methoxy-2-nitro-phenoxy)ethanamide

Systemtic Name: N-[2-(2-azanyl-2-oxidanylidene-ethyl)sulfanylphenyl]-2-(4-methoxy-2-nitro-phenoxy)ethanamide Openeye Name: N-[2-(2-amino-2-oxo-ethyl)sulfanylphenyl]-2-(4-methoxy-2-nitro-phenoxy)acetamide CAS Name: N-[2-[(2-amino-2-oxoethyl)thio]phenyl]-2-(4-methoxy-2-nitrophenoxy)acetamide IUPAC Name: N-[2-(2-amino-2-oxoethyl)sulfanylphenyl]-2-(4-methoxy-2-nitrophenoxy)acetamide Traditional Name: N-[2-[(2-amino-2-keto-ethyl)thio]phenyl]-2-(4-methoxy-2-nitro-phenoxy)acetamide Formula: C17H17N3O6S MolecularWeight: 391.39838

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OCC(=O)NC2=CC=CC=C2SCC(=O)N)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)OCC(=O)NC2=CC=CC=C2SCC(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C17H17N3O6S/c1-25-11-6-7-14(13(8-11)20(23)24)26-9-17(22)19-12-4-2-3-5-15(12)27-10-16(18)21/h2-8H,9-10H2,1H3,(H2,18,21)(H,19,22)