1-octoxy-2-(sulfinocarbamoylsulfamoyl)-4-(2,4,4-trimethylpentan-2-yl)benzene

Systemtic Name: 1-octoxy-2-(sulfinocarbamoylsulfamoyl)-4-(2,4,4-trimethylpentan-2-yl)benzene Openeye Name: 1-octoxy-2-(sulfinocarbamoylsulfamoyl)-4-(1,1,3,3-tetramethylbutyl)benzene CAS Name: 1-octoxy-2-[[oxo-(sulfinoamino)methyl]sulfamoyl]-4-(2,4,4-trimethylpentan-2-yl)benzene IUPAC Name: 1-octoxy-2-(sulfinocarbamoylsulfamoyl)-4-(2,4,4-trimethylpentan-2-yl)benzene Traditional Name: 1-octoxy-2-(sulfinocarbamoylsulfamoyl)-4-(1,1,3,3-tetramethylbutyl)benzene Formula: C23H40N2O6S2 MolecularWeight: 504.7035

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=C(C=C(C=C1)C(C)(C)CC(C)(C)C)S(=O)(=O)NC(=O)NS(=O)O

Isomeric SMILES

CCCCCCCCOC1=C(C=C(C=C1)C(C)(C)CC(C)(C)C)S(=O)(=O)NC(=O)NS(=O)O

InChI

InChI=1S/C23H40N2O6S2/c1-7-8-9-10-11-12-15-31-19-14-13-18(23(5,6)17-22(2,3)4)16-20(19)33(29,30)25-21(26)24-32(27)28/h13-14,16H,7-12,15,17H2,1-6H3,(H,27,28)(H2,24,25,26)