1-[[(E)-2-nitro-2-(2-oxidanylpropylamino)ethenyl]amino]propan-2-ol

Systemtic Name: 1-[[(E)-2-nitro-2-(2-oxidanylpropylamino)ethenyl]amino]propan-2-ol Openeye Name: 1-[[(E)-2-(2-hydroxypropylamino)-2-nitro-vinyl]amino]propan-2-ol CAS Name: 1-[[(E)-2-(2-hydroxypropylamino)-2-nitroethenyl]amino]-2-propanol IUPAC Name: 1-[[(E)-2-(2-hydroxypropylamino)-2-nitroethenyl]amino]propan-2-ol Traditional Name: 1-[[(E)-2-(2-hydroxypropylamino)-2-nitro-vinyl]amino]propan-2-ol Formula: C8H17N3O4 MolecularWeight: 219.23828

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC=C(NCC(C)O)[N+](=O)[O-])O

Isomeric SMILES

CC(CN/C=C(\NCC(C)O)/[N+](=O)[O-])O

InChI

InChI=1S/C8H17N3O4/c1-6(12)3-9-5-8(11(14)15)10-4-7(2)13/h5-7,9-10,12-13H,3-4H2,1-2H3/b8-5+