[5,5-dimethyl-3-(2,4,6-trimethylphenyl)-3,4-dihydropyrrol-2-yl] methylsulfanylmethaneperoxoate

Systemtic Name: [5,5-dimethyl-3-(2,4,6-trimethylphenyl)-3,4-dihydropyrrol-2-yl] methylsulfanylmethaneperoxoate Openeye Name: [5,5-dimethyl-3-(2,4,6-trimethylphenyl)-3,4-dihydropyrrol-2-yl] methylsulfanylperoxyformate CAS Name: (methylthio)methaneperoxoic acid [5,5-dimethyl-3-(2,4,6-trimethylphenyl)-3,4-dihydropyrrol-2-yl] ester IUPAC Name: [5,5-dimethyl-3-(2,4,6-trimethylphenyl)-3,4-dihydropyrrol-2-yl] methylsulfanylmethaneperoxoate Traditional Name: (methylthio)performic acid (3-mesityl-5,5-dimethyl-1-pyrrolin-2-yl) ester Formula: C17H23NO3S MolecularWeight: 321.43442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)C2CC(N=C2OOC(=O)SC)(C)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)C2CC(N=C2OOC(=O)SC)(C)C)C

InChI

InChI=1S/C17H23NO3S/c1-10-7-11(2)14(12(3)8-10)13-9-17(4,5)18-15(13)20-21-16(19)22-6/h7-8,13H,9H2,1-6H3