3-methoxy-7,9-dinitro-benzo[b][1]benzoxepine

Systemtic Name: 3-methoxy-7,9-dinitro-benzo[b][1]benzoxepine Openeye Name: 3-methoxy-7,9-dinitro-benzo[b][1]benzoxepine CAS Name: 3-methoxy-7,9-dinitrobenzo[b][1]benzoxepin IUPAC Name: 3-methoxy-7,9-dinitrobenzo[b][1]benzoxepine Traditional Name: 3-methoxy-7,9-dinitro-benzo[b][1]benzoxepin Formula: C15H10N2O6 MolecularWeight: 314.2497

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)OC3=CC(=CC(=C3C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

COC1=CC2=C(C=C1)OC3=CC(=CC(=C3C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C15H10N2O6/c1-22-11-3-5-14-9(6-11)2-4-12-13(17(20)21)7-10(16(18)19)8-15(12)23-14/h2-8H,1H3