N-[2-octoxy-5-(2,4,4-trimethylpentan-2-yl)phenyl]sulfonylmethanamide

Systemtic Name: N-[2-octoxy-5-(2,4,4-trimethylpentan-2-yl)phenyl]sulfonylmethanamide Openeye Name: N-[2-octoxy-5-(1,1,3,3-tetramethylbutyl)phenyl]sulfonylformamide CAS Name: N-[2-octoxy-5-(2,4,4-trimethylpentan-2-yl)phenyl]sulfonylformamide IUPAC Name: N-[2-octoxy-5-(2,4,4-trimethylpentan-2-yl)phenyl]sulfonylformamide Traditional Name: N-[2-octoxy-5-(1,1,3,3-tetramethylbutyl)phenyl]sulfonylformamide Formula: C23H39NO4S MolecularWeight: 425.62506

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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

Isomeric SMILES

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

InChI

InChI=1S/C23H39NO4S/c1-7-8-9-10-11-12-15-28-20-14-13-19(23(5,6)17-22(2,3)4)16-21(20)29(26,27)24-18-25/h13-14,16,18H,7-12,15,17H2,1-6H3,(H,24,25)