N-[2-methyl-4-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]phenyl]methanesulfonamide

Systemtic Name: N-[2-methyl-4-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]phenyl]methanesulfonamide Openeye Name: N-[2-methyl-4-[4-(1,1,3,3-tetramethylbutyl)phenoxy]phenyl]methanesulfonamide CAS Name: N-[2-methyl-4-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]phenyl]methanesulfonamide IUPAC Name: N-[2-methyl-4-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]phenyl]methanesulfonamide Traditional Name: N-[2-methyl-4-[4-(1,1,3,3-tetramethylbutyl)phenoxy]phenyl]methanesulfonamide Formula: C22H31NO3S MolecularWeight: 389.55144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC2=CC=C(C=C2)C(C)(C)CC(C)(C)C)NS(=O)(=O)C

Isomeric SMILES

CC1=C(C=CC(=C1)OC2=CC=C(C=C2)C(C)(C)CC(C)(C)C)NS(=O)(=O)C

InChI

InChI=1S/C22H31NO3S/c1-16-14-19(12-13-20(16)23-27(7,24)25)26-18-10-8-17(9-11-18)22(5,6)15-21(2,3)4/h8-14,23H,15H2,1-7H3