1-(3,4-dimethyl-2,6-dinitro-phenoxy)-1-ethoxy-ethanol

Systemtic Name: 1-(3,4-dimethyl-2,6-dinitro-phenoxy)-1-ethoxy-ethanol Openeye Name: 1-(3,4-dimethyl-2,6-dinitro-phenoxy)-1-ethoxy-ethanol CAS Name: 1-(3,4-dimethyl-2,6-dinitrophenoxy)-1-ethoxyethanol IUPAC Name: 1-(3,4-dimethyl-2,6-dinitrophenoxy)-1-ethoxyethanol Traditional Name: 1-(3,4-dimethyl-2,6-dinitro-phenoxy)-1-ethoxy-ethanol Formula: C12H16N2O7 MolecularWeight: 300.26464

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(C)(O)OC1=C(C=C(C(=C1[N+](=O)[O-])C)C)[N+](=O)[O-]

Isomeric SMILES

CCOC(C)(O)OC1=C(C=C(C(=C1[N+](=O)[O-])C)C)[N+](=O)[O-]

InChI

InChI=1S/C12H16N2O7/c1-5-20-12(4,15)21-11-9(13(16)17)6-7(2)8(3)10(11)14(18)19/h6,15H,5H2,1-4H3