5-tert-butyl-1,3-dinitro-2-propoxy-benzene

Systemtic Name: 5-tert-butyl-1,3-dinitro-2-propoxy-benzene Openeye Name: 5-tert-butyl-1,3-dinitro-2-propoxy-benzene CAS Name: 5-tert-butyl-1,3-dinitro-2-propoxybenzene IUPAC Name: 5-tert-butyl-1,3-dinitro-2-propoxybenzene Traditional Name: 5-tert-butyl-1,3-dinitro-2-propoxy-benzene Formula: C13H18N2O5 MolecularWeight: 282.29242

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1[N+](=O)[O-])C(C)(C)C)[N+](=O)[O-]

Isomeric SMILES

CCCOC1=C(C=C(C=C1[N+](=O)[O-])C(C)(C)C)[N+](=O)[O-]

InChI

InChI=1S/C13H18N2O5/c1-5-6-20-12-10(14(16)17)7-9(13(2,3)4)8-11(12)15(18)19/h7-8H,5-6H2,1-4H3