4-chloranyl-N-[4-(2-hydroxyethylsulfonyl)phenyl]-3-nitro-benzenesulfonamide

Systemtic Name: 4-chloranyl-N-[4-(2-hydroxyethylsulfonyl)phenyl]-3-nitro-benzenesulfonamide Openeye Name: 4-chloro-N-[4-(2-hydroxyethylsulfonyl)phenyl]-3-nitro-benzenesulfonamide CAS Name: 4-chloro-N-[4-(2-hydroxyethylsulfonyl)phenyl]-3-nitrobenzenesulfonamide IUPAC Name: 4-chloro-N-[4-(2-hydroxyethylsulfonyl)phenyl]-3-nitrobenzenesulfonamide Traditional Name: 4-chloro-N-[4-(2-hydroxyethylsulfonyl)phenyl]-3-nitro-benzenesulfonamide Formula: C14H13ClN2O7S2 MolecularWeight: 420.84522

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NS(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-])S(=O)(=O)CCO

Isomeric SMILES

C1=CC(=CC=C1NS(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-])S(=O)(=O)CCO

InChI

InChI=1S/C14H13ClN2O7S2/c15-13-6-5-12(9-14(13)17(19)20)26(23,24)16-10-1-3-11(4-2-10)25(21,22)8-7-18/h1-6,9,16,18H,7-8H2