1,2,4-trimethoxy-5-[3-methyl-1-(4-methylphenyl)sulfonyl-butyl]benzene

Systemtic Name: 1,2,4-trimethoxy-5-[3-methyl-1-(4-methylphenyl)sulfonyl-butyl]benzene Openeye Name: 1,2,4-trimethoxy-5-[3-methyl-1-(p-tolylsulfonyl)butyl]benzene CAS Name: 1,2,4-trimethoxy-5-[3-methyl-1-(4-methylphenyl)sulfonylbutyl]benzene IUPAC Name: 1,2,4-trimethoxy-5-[3-methyl-1-(4-methylphenyl)sulfonylbutyl]benzene Traditional Name: 1,2,4-trimethoxy-5-(3-methyl-1-tosyl-butyl)benzene Formula: C21H28O5S MolecularWeight: 392.50902

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(CC(C)C)C2=CC(=C(C=C2OC)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C(CC(C)C)C2=CC(=C(C=C2OC)OC)OC

InChI

InChI=1S/C21H28O5S/c1-14(2)11-21(27(22,23)16-9-7-15(3)8-10-16)17-12-19(25-5)20(26-6)13-18(17)24-4/h7-10,12-14,21H,11H2,1-6H3