(2E)-8-methyl-2-[(4-phenyldiazenylphenyl)hydrazinylidene]-3-(trioxidanylsulfanyl)naphthalen-1-one

Systemtic Name: (2E)-8-methyl-2-[(4-phenyldiazenylphenyl)hydrazinylidene]-3-(trioxidanylsulfanyl)naphthalen-1-one Openeye Name: (2E)-8-methyl-2-[(4-phenylazophenyl)hydrazono]-3-(trioxidanylsulfanyl)naphthalen-1-one CAS Name: (3E)-5-methyl-4-oxo-3-[(4-phenyldiazenylphenyl)hydrazinylidene]-2-naphthalenesulfenic acid hydroperoxy ester IUPAC Name: (2E)-8-methyl-2-[(4-phenyldiazenylphenyl)hydrazinylidene]-3-(trioxidanylsulfanyl)naphthalen-1-one Traditional Name: (2E)-8-methyl-2-[(4-phenylazophenyl)hydrazono]-3-(trioxidanylthio)naphthalen-1-one Formula: C23H18N4O4S MolecularWeight: 446.47842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1C(=O)C(=NNC3=CC=C(C=C3)N=NC4=CC=CC=C4)C(=C2)SOOO

Isomeric SMILES

CC1=CC=CC2=C1C(=O)/C(=N\NC3=CC=C(C=C3)N=NC4=CC=CC=C4)/C(=C2)SOOO

InChI

InChI=1S/C23H18N4O4S/c1-15-6-5-7-16-14-20(32-31-30-29)22(23(28)21(15)16)27-26-19-12-10-18(11-13-19)25-24-17-8-3-2-4-9-17/h2-14,26,29H,1H3/b25-24?,27-22-