4-[2,4-bis(chloranyl)phenoxy]-2-nitro-benzo[b][1]benzoxepine

Systemtic Name: 4-[2,4-bis(chloranyl)phenoxy]-2-nitro-benzo[b][1]benzoxepine Openeye Name: 4-(2,4-dichlorophenoxy)-2-nitro-benzo[b][1]benzoxepine CAS Name: 4-(2,4-dichlorophenoxy)-2-nitrobenzo[b][1]benzoxepin IUPAC Name: 4-(2,4-dichlorophenoxy)-2-nitrobenzo[b][1]benzoxepine Traditional Name: 4-(2,4-dichlorophenoxy)-2-nitro-benzo[b][1]benzoxepin Formula: C20H11Cl2NO4 MolecularWeight: 400.21164

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC3=C(O2)C=C(C=C3OC4=C(C=C(C=C4)Cl)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=CC3=C(O2)C=C(C=C3OC4=C(C=C(C=C4)Cl)Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H11Cl2NO4/c21-13-6-8-18(16(22)9-13)27-20-11-14(23(24)25)10-19-15(20)7-5-12-3-1-2-4-17(12)26-19/h1-11H