N3-[2-(2-hydroxyethylamino)-5-nitro-phenyl]benzene-1,3-disulfonamide

Systemtic Name: N3-[2-(2-hydroxyethylamino)-5-nitro-phenyl]benzene-1,3-disulfonamide Openeye Name: N3-[2-(2-hydroxyethylamino)-5-nitro-phenyl]benzene-1,3-disulfonamide CAS Name: N3-[2-(2-hydroxyethylamino)-5-nitrophenyl]benzene-1,3-disulfonamide IUPAC Name: 3-N-[2-(2-hydroxyethylamino)-5-nitrophenyl]benzene-1,3-disulfonamide Traditional Name: N'-[2-(2-hydroxyethylamino)-5-nitro-phenyl]benzene-1,3-disulfonamide Formula: C14H16N4O7S2 MolecularWeight: 416.42944

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H16N4O7S2/c15-26(22,23)11-2-1-3-12(9-11)27(24,25)17-14-8-10(18(20)21)4-5-13(14)16-6-7-19/h1-5,8-9,16-17,19H,6-7H2,(H2,15,22,23)