4-bromanyl-N-[2-(2-hydroxyethylamino)-5-nitro-phenyl]-3-methyl-benzenesulfonamide

Systemtic Name: 4-bromanyl-N-[2-(2-hydroxyethylamino)-5-nitro-phenyl]-3-methyl-benzenesulfonamide Openeye Name: 4-bromo-N-[2-(2-hydroxyethylamino)-5-nitro-phenyl]-3-methyl-benzenesulfonamide CAS Name: 4-bromo-N-[2-(2-hydroxyethylamino)-5-nitrophenyl]-3-methylbenzenesulfonamide IUPAC Name: 4-bromo-N-[2-(2-hydroxyethylamino)-5-nitrophenyl]-3-methylbenzenesulfonamide Traditional Name: 4-bromo-N-[2-(2-hydroxyethylamino)-5-nitro-phenyl]-3-methyl-benzenesulfonamide Formula: C15H16BrN3O5S MolecularWeight: 430.27364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])NCCO)Br

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])NCCO)Br

InChI

InChI=1S/C15H16BrN3O5S/c1-10-8-12(3-4-13(10)16)25(23,24)18-15-9-11(19(21)22)2-5-14(15)17-6-7-20/h2-5,8-9,17-18,20H,6-7H2,1H3