3-[(2,4-dinitrophenyl)-propyl-amino]propane-1,2-diol

Systemtic Name: 3-[(2,4-dinitrophenyl)-propyl-amino]propane-1,2-diol Openeye Name: 3-(2,4-dinitro-N-propyl-anilino)propane-1,2-diol CAS Name: 3-(2,4-dinitro-N-propylanilino)propane-1,2-diol IUPAC Name: 3-(2,4-dinitro-N-propylanilino)propane-1,2-diol Traditional Name: 3-(2,4-dinitro-N-propyl-anilino)propane-1,2-diol Formula: C12H17N3O6 MolecularWeight: 299.27988

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC(CO)O)C1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCCN(CC(CO)O)C1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C12H17N3O6/c1-2-5-13(7-10(17)8-16)11-4-3-9(14(18)19)6-12(11)15(20)21/h3-4,6,10,16-17H,2,5,7-8H2,1H3