7-(2-bromanylphenoxy)-3-chloranyl-9-nitro-5H-benzo[b][1,4]benzoxazepin-6-one

Systemtic Name: 7-(2-bromanylphenoxy)-3-chloranyl-9-nitro-5H-benzo[b][1,4]benzoxazepin-6-one Openeye Name: 7-(2-bromophenoxy)-3-chloro-9-nitro-5H-benzo[b][1,4]benzoxazepin-6-one CAS Name: 7-(2-bromophenoxy)-3-chloro-9-nitro-5H-benzo[b][1,4]benzoxazepin-6-one IUPAC Name: 7-(2-bromophenoxy)-3-chloro-9-nitro-5H-benzo[b][1,4]benzoxazepin-6-one Traditional Name: 7-(2-bromophenoxy)-3-chloro-9-nitro-5H-benzo[b][1,4]benzoxazepin-6-one Formula: C19H10BrClN2O5 MolecularWeight: 461.6501

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)OC2=CC(=CC3=C2C(=O)NC4=C(O3)C=CC(=C4)Cl)[N+](=O)[O-])Br

Isomeric SMILES

C1=CC=C(C(=C1)OC2=CC(=CC3=C2C(=O)NC4=C(O3)C=CC(=C4)Cl)[N+](=O)[O-])Br

InChI

InChI=1S/C19H10BrClN2O5/c20-12-3-1-2-4-14(12)27-16-8-11(23(25)26)9-17-18(16)19(24)22-13-7-10(21)5-6-15(13)28-17/h1-9H,(H,22,24)