N-[2-(2-hydroxyethylamino)-5-nitro-phenyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide

Systemtic Name: N-[2-(2-hydroxyethylamino)-5-nitro-phenyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Openeye Name: N-[2-(2-hydroxyethylamino)-5-nitro-phenyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide CAS Name: N-[2-(2-hydroxyethylamino)-5-nitrophenyl]-2,3-dihydro-1,4-benzodioxin-6-sulfonamide IUPAC Name: N-[2-(2-hydroxyethylamino)-5-nitrophenyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Traditional Name: N-[2-(2-hydroxyethylamino)-5-nitro-phenyl]-2,3-dihydro-1,4-benzodioxin-6-sulfonamide Formula: C16H17N3O7S MolecularWeight: 395.38708

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)S(=O)(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])NCCO

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)S(=O)(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])NCCO

InChI

InChI=1S/C16H17N3O7S/c20-6-5-17-13-3-1-11(19(21)22)9-14(13)18-27(23,24)12-2-4-15-16(10-12)26-8-7-25-15/h1-4,9-10,17-18,20H,5-8H2