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

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-2-nitro-benzenesulfonamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-2-nitro-benzenesulfonamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-2-nitrobenzenesulfonamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-2-nitrobenzenesulfonamide Traditional Name: N-homoveratryl-N-methyl-2-nitro-benzenesulfonamide Formula: C17H20N2O6S MolecularWeight: 380.4155

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC(=C(C=C1)OC)OC)S(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CN(CCC1=CC(=C(C=C1)OC)OC)S(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C17H20N2O6S/c1-18(11-10-13-8-9-15(24-2)16(12-13)25-3)26(22,23)17-7-5-4-6-14(17)19(20)21/h4-9,12H,10-11H2,1-3H3