2-(4-methoxyphenyl)-1,3,5-trinitro-benzene

Systemtic Name: 2-(4-methoxyphenyl)-1,3,5-trinitro-benzene Openeye Name: 2-(4-methoxyphenyl)-1,3,5-trinitro-benzene CAS Name: 2-(4-methoxyphenyl)-1,3,5-trinitrobenzene IUPAC Name: 2-(4-methoxyphenyl)-1,3,5-trinitrobenzene Traditional Name: 2-(4-methoxyphenyl)-1,3,5-trinitro-benzene Formula: C13H9N3O7 MolecularWeight: 319.22646

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(C=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(C=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H9N3O7/c1-23-10-4-2-8(3-5-10)13-11(15(19)20)6-9(14(17)18)7-12(13)16(21)22/h2-7H,1H3