N-[3-[2-[(4-nitrophenyl)amino]-2-oxidanylidene-ethyl]sulfanylphenyl]-2-phenoxy-ethanamide

Systemtic Name: N-[3-[2-[(4-nitrophenyl)amino]-2-oxidanylidene-ethyl]sulfanylphenyl]-2-phenoxy-ethanamide Openeye Name: N-[3-[2-(4-nitroanilino)-2-oxo-ethyl]sulfanylphenyl]-2-phenoxy-acetamide CAS Name: N-[3-[[2-(4-nitroanilino)-2-oxoethyl]thio]phenyl]-2-phenoxyacetamide IUPAC Name: N-[3-[2-(4-nitroanilino)-2-oxoethyl]sulfanylphenyl]-2-phenoxyacetamide Traditional Name: N-[3-[[2-keto-2-(4-nitroanilino)ethyl]thio]phenyl]-2-phenoxy-acetamide Formula: C22H19N3O5S MolecularWeight: 437.46836

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCC(=O)NC2=CC(=CC=C2)SCC(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)OCC(=O)NC2=CC(=CC=C2)SCC(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H19N3O5S/c26-21(14-30-19-6-2-1-3-7-19)24-17-5-4-8-20(13-17)31-15-22(27)23-16-9-11-18(12-10-16)25(28)29/h1-13H,14-15H2,(H,23,27)(H,24,26)