N-ethanoyl-2-[(2-methoxy-4-nitro-phenyl)diazenyl]-N-[2-(trioxidanylsulfanyl)naphthalen-1-yl]ethanamide

Systemtic Name: N-ethanoyl-2-[(2-methoxy-4-nitro-phenyl)diazenyl]-N-[2-(trioxidanylsulfanyl)naphthalen-1-yl]ethanamide Openeye Name: N-acetyl-2-(2-methoxy-4-nitro-phenyl)azo-N-[2-(trioxidanylsulfanyl)-1-naphthyl]acetamide CAS Name: 1-[acetyl-[2-(2-methoxy-4-nitrophenyl)azo-1-oxoethyl]amino]-2-naphthalenesulfenic acid hydroperoxy ester IUPAC Name: N-acetyl-2-[(2-methoxy-4-nitrophenyl)diazenyl]-N-[2-(trioxidanylsulfanyl)naphthalen-1-yl]acetamide Traditional Name: N-acetyl-2-(2-methoxy-4-nitro-phenyl)azo-N-[2-(trioxidanylthio)-1-naphthyl]acetamide Formula: C21H18N4O8S MolecularWeight: 486.45462

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C1=C(C=CC2=CC=CC=C21)SOOO)C(=O)CN=NC3=C(C=C(C=C3)[N+](=O)[O-])OC

Isomeric SMILES

CC(=O)N(C1=C(C=CC2=CC=CC=C21)SOOO)C(=O)CN=NC3=C(C=C(C=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C21H18N4O8S/c1-13(26)24(21-16-6-4-3-5-14(16)7-10-19(21)34-33-32-30)20(27)12-22-23-17-9-8-15(25(28)29)11-18(17)31-2/h3-11,30H,12H2,1-2H3