2-[1,3-benzodioxol-5-ylmethyl-(2,3,4,6-tetramethylphenyl)peroxysulfanyl-amino]-3-methyl-N-oxidanyl-butanamide

Systemtic Name: 2-[1,3-benzodioxol-5-ylmethyl-(2,3,4,6-tetramethylphenyl)peroxysulfanyl-amino]-3-methyl-N-oxidanyl-butanamide Openeye Name: 2-[1,3-benzodioxol-5-ylmethyl-(2,3,4,6-tetramethylphenyl)peroxysulfanyl-amino]-3-methyl-butanehydroxamic acid CAS Name: 2-[1,3-benzodioxol-5-ylmethyl-[(2,3,4,6-tetramethylphenyl)dioxythio]amino]-N-hydroxy-3-methylbutanamide IUPAC Name: 2-[1,3-benzodioxol-5-ylmethyl-(2,3,4,6-tetramethylphenyl)peroxysulfanylamino]-N-hydroxy-3-methylbutanamide Traditional Name: 3-methyl-2-[piperonyl-[(2,3,4,6-tetramethylphenyl)peroxythio]amino]butanehydroxamic acid Formula: C23H30N2O6S MolecularWeight: 462.5591

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C)C)OOSN(CC2=CC3=C(C=C2)OCO3)C(C(C)C)C(=O)NO)C

Isomeric SMILES

CC1=CC(=C(C(=C1C)C)OOSN(CC2=CC3=C(C=C2)OCO3)C(C(C)C)C(=O)NO)C

InChI

InChI=1S/C23H30N2O6S/c1-13(2)21(23(26)24-27)25(11-18-7-8-19-20(10-18)29-12-28-19)32-31-30-22-15(4)9-14(3)16(5)17(22)6/h7-10,13,21,27H,11-12H2,1-6H3,(H,24,26)