(8-nitro-6H-benzo[b][1,4]benzodioxepin-2-yl)-phenyl-methanone

Systemtic Name: (8-nitro-6H-benzo[b][1,4]benzodioxepin-2-yl)-phenyl-methanone Openeye Name: (8-nitro-6H-benzo[b][1,4]benzodioxepin-2-yl)-phenyl-methanone CAS Name: (8-nitro-6H-benzo[b][1,4]benzodioxepin-2-yl)-phenylmethanone IUPAC Name: (8-nitro-6H-benzo[b][1,4]benzodioxepin-2-yl)-phenylmethanone Traditional Name: (8-nitro-6H-benzo[b][1,4]benzodioxepin-2-yl)-phenyl-methanone Formula: C20H13NO5 MolecularWeight: 347.32092

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=CC(=C2)[N+](=O)[O-])OC3=C(O1)C=CC(=C3)C(=O)C4=CC=CC=C4

Isomeric SMILES

C1C2=C(C=CC(=C2)[N+](=O)[O-])OC3=C(O1)C=CC(=C3)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C20H13NO5/c22-20(13-4-2-1-3-5-13)14-6-8-18-19(11-14)26-17-9-7-16(21(23)24)10-15(17)12-25-18/h1-11H,12H2