2-[3-azanyl-2-(2-hydroxyethyl)-5-(2-hydroxyethylamino)-4-nitro-phenyl]ethanol

Systemtic Name: 2-[3-azanyl-2-(2-hydroxyethyl)-5-(2-hydroxyethylamino)-4-nitro-phenyl]ethanol Openeye Name: 2-[3-amino-2-(2-hydroxyethyl)-5-(2-hydroxyethylamino)-4-nitro-phenyl]ethanol CAS Name: 2-[3-amino-2-(2-hydroxyethyl)-5-(2-hydroxyethylamino)-4-nitrophenyl]ethanol IUPAC Name: 2-[3-amino-2-(2-hydroxyethyl)-5-(2-hydroxyethylamino)-4-nitrophenyl]ethanol Traditional Name: 2-[3-amino-2-(2-hydroxyethyl)-5-(2-hydroxyethylamino)-4-nitro-phenyl]ethanol Formula: C12H19N3O5 MolecularWeight: 285.29636

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=C(C(=C1NCCO)[N+](=O)[O-])N)CCO)CCO

Isomeric SMILES

C1=C(C(=C(C(=C1NCCO)[N+](=O)[O-])N)CCO)CCO

InChI

InChI=1S/C12H19N3O5/c13-11-9(2-5-17)8(1-4-16)7-10(14-3-6-18)12(11)15(19)20/h7,14,16-18H,1-6,13H2