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

Systemtic Name: 4-chloranyl-N-[(2,4-dimethoxyphenyl)methyl]-N-methyl-3-nitro-benzenesulfonamide Openeye Name: 4-chloro-N-[(2,4-dimethoxyphenyl)methyl]-N-methyl-3-nitro-benzenesulfonamide CAS Name: 4-chloro-N-[(2,4-dimethoxyphenyl)methyl]-N-methyl-3-nitrobenzenesulfonamide IUPAC Name: 4-chloro-N-[(2,4-dimethoxyphenyl)methyl]-N-methyl-3-nitrobenzenesulfonamide Traditional Name: 4-chloro-N-(2,4-dimethoxybenzyl)-N-methyl-3-nitro-benzenesulfonamide Formula: C16H17ClN2O6S MolecularWeight: 400.83398

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(C=C(C=C1)OC)OC)S(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CN(CC1=C(C=C(C=C1)OC)OC)S(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H17ClN2O6S/c1-18(10-11-4-5-12(24-2)8-16(11)25-3)26(22,23)13-6-7-14(17)15(9-13)19(20)21/h4-9H,10H2,1-3H3