N-ethanoyl-N-(2-methoxyphenyl)-2-[[2-nitro-4-(trioxidanylsulfanyl)phenyl]diazenyl]ethanamide

Systemtic Name: N-ethanoyl-N-(2-methoxyphenyl)-2-[[2-nitro-4-(trioxidanylsulfanyl)phenyl]diazenyl]ethanamide Openeye Name: N-acetyl-N-(2-methoxyphenyl)-2-[2-nitro-4-(trioxidanylsulfanyl)phenyl]azo-acetamide CAS Name: 4-[2-(N-acetyl-2-methoxyanilino)-2-oxoethyl]azo-3-nitrobenzenesulfenic acid hydroperoxy ester IUPAC Name: N-acetyl-N-(2-methoxyphenyl)-2-[[2-nitro-4-(trioxidanylsulfanyl)phenyl]diazenyl]acetamide Traditional Name: N-acetyl-N-(2-methoxyphenyl)-2-[2-nitro-4-(trioxidanylthio)phenyl]azo-acetamide Formula: C17H16N4O8S MolecularWeight: 436.39594

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C1=CC=CC=C1OC)C(=O)CN=NC2=C(C=C(C=C2)SOOO)[N+](=O)[O-]

Isomeric SMILES

CC(=O)N(C1=CC=CC=C1OC)C(=O)CN=NC2=C(C=C(C=C2)SOOO)[N+](=O)[O-]

InChI

InChI=1S/C17H16N4O8S/c1-11(22)20(14-5-3-4-6-16(14)27-2)17(23)10-18-19-13-8-7-12(30-29-28-26)9-15(13)21(24)25/h3-9,26H,10H2,1-2H3