1-[1-(4-ethyl-2,6-dinitro-phenyl)propylamino]propan-2-ol

Systemtic Name: 1-[1-(4-ethyl-2,6-dinitro-phenyl)propylamino]propan-2-ol Openeye Name: 1-[1-(4-ethyl-2,6-dinitro-phenyl)propylamino]propan-2-ol CAS Name: 1-[1-(4-ethyl-2,6-dinitrophenyl)propylamino]-2-propanol IUPAC Name: 1-[1-(4-ethyl-2,6-dinitrophenyl)propylamino]propan-2-ol Traditional Name: 1-[1-(4-ethyl-2,6-dinitro-phenyl)propylamino]propan-2-ol Formula: C14H21N3O5 MolecularWeight: 311.33364

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C(=C1)[N+](=O)[O-])C(CC)NCC(C)O)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC(=C(C(=C1)[N+](=O)[O-])C(CC)NCC(C)O)[N+](=O)[O-]

InChI

InChI=1S/C14H21N3O5/c1-4-10-6-12(16(19)20)14(13(7-10)17(21)22)11(5-2)15-8-9(3)18/h6-7,9,11,15,18H,4-5,8H2,1-3H3