N-methyl-N-[3-methyl-5-(3-oxidanylpropoxy)phenyl]-2-methylsulfonyl-benzenesulfonamide

Systemtic Name: N-methyl-N-[3-methyl-5-(3-oxidanylpropoxy)phenyl]-2-methylsulfonyl-benzenesulfonamide Openeye Name: N-[3-(3-hydroxypropoxy)-5-methyl-phenyl]-N-methyl-2-methylsulfonyl-benzenesulfonamide CAS Name: N-[3-(3-hydroxypropoxy)-5-methylphenyl]-N-methyl-2-methylsulfonylbenzenesulfonamide IUPAC Name: N-[3-(3-hydroxypropoxy)-5-methylphenyl]-N-methyl-2-methylsulfonylbenzenesulfonamide Traditional Name: N-[3-(3-hydroxypropoxy)-5-methyl-phenyl]-2-mesyl-N-methyl-benzenesulfonamide Formula: C18H23NO6S2 MolecularWeight: 413.50832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCCCO)N(C)S(=O)(=O)C2=CC=CC=C2S(=O)(=O)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCCCO)N(C)S(=O)(=O)C2=CC=CC=C2S(=O)(=O)C

InChI

InChI=1S/C18H23NO6S2/c1-14-11-15(13-16(12-14)25-10-6-9-20)19(2)27(23,24)18-8-5-4-7-17(18)26(3,21)22/h4-5,7-8,11-13,20H,6,9-10H2,1-3H3