2-tert-butyl-4-methoxy-1,3,5-trinitro-benzene

Systemtic Name: 2-tert-butyl-4-methoxy-1,3,5-trinitro-benzene Openeye Name: 2-tert-butyl-4-methoxy-1,3,5-trinitro-benzene CAS Name: 2-tert-butyl-4-methoxy-1,3,5-trinitrobenzene IUPAC Name: 2-tert-butyl-4-methoxy-1,3,5-trinitrobenzene Traditional Name: 2-tert-butyl-4-methoxy-1,3,5-trinitro-benzene Formula: C11H13N3O7 MolecularWeight: 299.23682

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13N3O7/c1-11(2,3)8-6(12(15)16)5-7(13(17)18)10(21-4)9(8)14(19)20/h5H,1-4H3