2-chloranyl-N-[4-(2-hydroxyethylamino)-3-(2-hydroxyethylsulfonyl)phenyl]-5-nitro-benzenesulfonamide

Systemtic Name: 2-chloranyl-N-[4-(2-hydroxyethylamino)-3-(2-hydroxyethylsulfonyl)phenyl]-5-nitro-benzenesulfonamide Openeye Name: 2-chloro-N-[4-(2-hydroxyethylamino)-3-(2-hydroxyethylsulfonyl)phenyl]-5-nitro-benzenesulfonamide CAS Name: 2-chloro-N-[4-(2-hydroxyethylamino)-3-(2-hydroxyethylsulfonyl)phenyl]-5-nitrobenzenesulfonamide IUPAC Name: 2-chloro-N-[4-(2-hydroxyethylamino)-3-(2-hydroxyethylsulfonyl)phenyl]-5-nitrobenzenesulfonamide Traditional Name: 2-chloro-N-[4-(2-hydroxyethylamino)-3-(2-hydroxyethylsulfonyl)phenyl]-5-nitro-benzenesulfonamide Formula: C16H18ClN3O8S2 MolecularWeight: 479.91242

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18ClN3O8S2/c17-13-3-2-12(20(23)24)10-15(13)30(27,28)19-11-1-4-14(18-5-6-21)16(9-11)29(25,26)8-7-22/h1-4,9-10,18-19,21-22H,5-8H2