4-chloranyl-N-(2,5-diethoxyphenyl)-3-nitro-benzenesulfonamide

Systemtic Name: 4-chloranyl-N-(2,5-diethoxyphenyl)-3-nitro-benzenesulfonamide Openeye Name: 4-chloro-N-(2,5-diethoxyphenyl)-3-nitro-benzenesulfonamide CAS Name: 4-chloro-N-(2,5-diethoxyphenyl)-3-nitrobenzenesulfonamide IUPAC Name: 4-chloro-N-(2,5-diethoxyphenyl)-3-nitrobenzenesulfonamide Traditional Name: 4-chloro-N-(2,5-diethoxyphenyl)-3-nitro-benzenesulfonamide Formula: C16H17ClN2O6S MolecularWeight: 400.83398

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)OCC)NS(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC(=C(C=C1)OCC)NS(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H17ClN2O6S/c1-3-24-11-5-8-16(25-4-2)14(9-11)18-26(22,23)12-6-7-13(17)15(10-12)19(20)21/h5-10,18H,3-4H2,1-2H3