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

Systemtic Name: 4-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]-N-methyl-3-nitro-benzenesulfonamide Openeye Name: 4-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]-N-methyl-3-nitro-benzenesulfonamide CAS Name: 4-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]-N-methyl-3-nitrobenzenesulfonamide IUPAC Name: 4-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]-N-methyl-3-nitrobenzenesulfonamide Traditional Name: 4-[homoveratryl(methyl)amino]-N-methyl-3-nitro-benzenesulfonamide Formula: C18H23N3O6S MolecularWeight: 409.45672

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Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)C1=CC(=C(C=C1)N(C)CCC2=CC(=C(C=C2)OC)OC)[N+](=O)[O-]

Isomeric SMILES

CNS(=O)(=O)C1=CC(=C(C=C1)N(C)CCC2=CC(=C(C=C2)OC)OC)[N+](=O)[O-]

InChI

InChI=1S/C18H23N3O6S/c1-19-28(24,25)14-6-7-15(16(12-14)21(22)23)20(2)10-9-13-5-8-17(26-3)18(11-13)27-4/h5-8,11-12,19H,9-10H2,1-4H3