3-methyl-2-[(4-methyl-3-nitro-phenyl)methyl-(4-methylphenyl)peroxysulfanyl-amino]-N-oxidanyl-butanamide

Systemtic Name: 3-methyl-2-[(4-methyl-3-nitro-phenyl)methyl-(4-methylphenyl)peroxysulfanyl-amino]-N-oxidanyl-butanamide Openeye Name: 3-methyl-2-[(4-methyl-3-nitro-phenyl)methyl-(p-tolylperoxysulfanyl)amino]butanehydroxamic acid CAS Name: N-hydroxy-3-methyl-2-[(4-methyl-3-nitrophenyl)methyl-[(4-methylphenyl)dioxythio]amino]butanamide IUPAC Name: N-hydroxy-3-methyl-2-[(4-methyl-3-nitrophenyl)methyl-(4-methylphenyl)peroxysulfanylamino]butanamide Traditional Name: 3-methyl-2-[(4-methyl-3-nitro-benzyl)-(p-tolylperoxythio)amino]butanehydroxamic acid Formula: C20H25N3O6S MolecularWeight: 435.494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OOSN(CC2=CC(=C(C=C2)C)[N+](=O)[O-])C(C(C)C)C(=O)NO

Isomeric SMILES

CC1=CC=C(C=C1)OOSN(CC2=CC(=C(C=C2)C)[N+](=O)[O-])C(C(C)C)C(=O)NO

InChI

InChI=1S/C20H25N3O6S/c1-13(2)19(20(24)21-25)22(30-29-28-17-9-5-14(3)6-10-17)12-16-8-7-15(4)18(11-16)23(26)27/h5-11,13,19,25H,12H2,1-4H3,(H,21,24)