N-cyclopropyl-N-[(2,5-dimethoxyphenyl)methyl]-2,3-dimethyl-5-nitro-benzenesulfonamide

Systemtic Name: N-cyclopropyl-N-[(2,5-dimethoxyphenyl)methyl]-2,3-dimethyl-5-nitro-benzenesulfonamide Openeye Name: N-cyclopropyl-N-[(2,5-dimethoxyphenyl)methyl]-2,3-dimethyl-5-nitro-benzenesulfonamide CAS Name: N-cyclopropyl-N-[(2,5-dimethoxyphenyl)methyl]-2,3-dimethyl-5-nitrobenzenesulfonamide IUPAC Name: N-cyclopropyl-N-[(2,5-dimethoxyphenyl)methyl]-2,3-dimethyl-5-nitrobenzenesulfonamide Traditional Name: N-cyclopropyl-N-(2,5-dimethoxybenzyl)-2,3-dimethyl-5-nitro-benzenesulfonamide Formula: C20H24N2O6S MolecularWeight: 420.47936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C)S(=O)(=O)N(CC2=C(C=CC(=C2)OC)OC)C3CC3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC(=C1C)S(=O)(=O)N(CC2=C(C=CC(=C2)OC)OC)C3CC3)[N+](=O)[O-]

InChI

InChI=1S/C20H24N2O6S/c1-13-9-17(22(23)24)11-20(14(13)2)29(25,26)21(16-5-6-16)12-15-10-18(27-3)7-8-19(15)28-4/h7-11,16H,5-6,12H2,1-4H3