4-(2-methoxyphenoxy)-2-nitro-benzo[b][1]benzoxepine

Systemtic Name: 4-(2-methoxyphenoxy)-2-nitro-benzo[b][1]benzoxepine Openeye Name: 4-(2-methoxyphenoxy)-2-nitro-benzo[b][1]benzoxepine CAS Name: 4-(2-methoxyphenoxy)-2-nitrobenzo[b][1]benzoxepin IUPAC Name: 4-(2-methoxyphenoxy)-2-nitrobenzo[b][1]benzoxepine Traditional Name: 4-(2-methoxyphenoxy)-2-nitro-benzo[b][1]benzoxepin Formula: C21H15NO5 MolecularWeight: 361.3475

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1OC2=CC(=CC3=C2C=CC4=CC=CC=C4O3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC=C1OC2=CC(=CC3=C2C=CC4=CC=CC=C4O3)[N+](=O)[O-]

InChI

InChI=1S/C21H15NO5/c1-25-18-8-4-5-9-19(18)27-21-13-15(22(23)24)12-20-16(21)11-10-14-6-2-3-7-17(14)26-20/h2-13H,1H3