5-methoxy-1,5,6-trinitro-cyclohexa-1,3-diene

Systemtic Name: 5-methoxy-1,5,6-trinitro-cyclohexa-1,3-diene Openeye Name: 5-methoxy-1,5,6-trinitro-cyclohexa-1,3-diene CAS Name: 5-methoxy-1,5,6-trinitrocyclohexa-1,3-diene IUPAC Name: 5-methoxy-1,5,6-trinitrocyclohexa-1,3-diene Traditional Name: 5-methoxy-1,5,6-trinitro-cyclohexa-1,3-diene Formula: C7H7N3O7 MolecularWeight: 245.14638

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H7N3O7/c1-17-7(10(15)16)4-2-3-5(8(11)12)6(7)9(13)14/h2-4,6H,1H3