N-[2-(3,4-dimethoxyphenyl)ethyl]-4-methylsulfonyl-benzenesulfonamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-methylsulfonyl-benzenesulfonamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-methylsulfonyl-benzenesulfonamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-methylsulfonylbenzenesulfonamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-methylsulfonylbenzenesulfonamide Traditional Name: N-homoveratryl-4-mesyl-benzenesulfonamide Formula: C17H21NO6S2 MolecularWeight: 399.48174

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNS(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)C)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNS(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)C)OC

InChI

InChI=1S/C17H21NO6S2/c1-23-16-9-4-13(12-17(16)24-2)10-11-18-26(21,22)15-7-5-14(6-8-15)25(3,19)20/h4-9,12,18H,10-11H2,1-3H3