2-(2-azanylethoxymethyl)-3-nitro-6-(2-oxidanylpropylamino)phenol

Systemtic Name: 2-(2-azanylethoxymethyl)-3-nitro-6-(2-oxidanylpropylamino)phenol Openeye Name: 2-(2-aminoethoxymethyl)-6-(2-hydroxypropylamino)-3-nitro-phenol CAS Name: 2-(2-aminoethoxymethyl)-6-(2-hydroxypropylamino)-3-nitrophenol IUPAC Name: 2-(2-aminoethoxymethyl)-6-(2-hydroxypropylamino)-3-nitrophenol Traditional Name: 2-(2-aminoethoxymethyl)-6-(2-hydroxypropylamino)-3-nitro-phenol Formula: C12H19N3O5 MolecularWeight: 285.29636

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC1=C(C(=C(C=C1)[N+](=O)[O-])COCCN)O)O

Isomeric SMILES

CC(CNC1=C(C(=C(C=C1)[N+](=O)[O-])COCCN)O)O

InChI

InChI=1S/C12H19N3O5/c1-8(16)6-14-10-2-3-11(15(18)19)9(12(10)17)7-20-5-4-13/h2-3,8,14,16-17H,4-7,13H2,1H3