N-[2-(3,4-dimethoxyphenyl)ethyl]-N,2,3-trimethyl-5-nitro-benzenesulfonamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-N,2,3-trimethyl-5-nitro-benzenesulfonamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-N,2,3-trimethyl-5-nitro-benzenesulfonamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-N,2,3-trimethyl-5-nitrobenzenesulfonamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-N,2,3-trimethyl-5-nitrobenzenesulfonamide Traditional Name: N-homoveratryl-N,2,3-trimethyl-5-nitro-benzenesulfonamide Formula: C19H24N2O6S MolecularWeight: 408.46866

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C)S(=O)(=O)N(C)CCC2=CC(=C(C=C2)OC)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC(=C1C)S(=O)(=O)N(C)CCC2=CC(=C(C=C2)OC)OC)[N+](=O)[O-]

InChI

InChI=1S/C19H24N2O6S/c1-13-10-16(21(22)23)12-19(14(13)2)28(24,25)20(3)9-8-15-6-7-17(26-4)18(11-15)27-5/h6-7,10-12H,8-9H2,1-5H3