N-[3-[(9-nitro-6-oxidanylidene-5H-benzo[b][1,4]benzoxazepin-7-yl)oxy]phenyl]ethanamide

Systemtic Name: N-[3-[(9-nitro-6-oxidanylidene-5H-benzo[b][1,4]benzoxazepin-7-yl)oxy]phenyl]ethanamide Openeye Name: N-[3-[(9-nitro-6-oxo-5H-benzo[b][1,4]benzoxazepin-7-yl)oxy]phenyl]acetamide CAS Name: N-[3-[(9-nitro-6-oxo-5H-benzo[b][1,4]benzoxazepin-7-yl)oxy]phenyl]acetamide IUPAC Name: N-[3-[(9-nitro-6-oxo-5H-benzo[b][1,4]benzoxazepin-7-yl)oxy]phenyl]acetamide Traditional Name: N-[3-[(6-keto-9-nitro-5H-benzo[b][1,4]benzoxazepin-7-yl)oxy]phenyl]acetamide Formula: C21H15N3O6 MolecularWeight: 405.3603

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=CC=C1)OC2=CC(=CC3=C2C(=O)NC4=CC=CC=C4O3)[N+](=O)[O-]

Isomeric SMILES

CC(=O)NC1=CC(=CC=C1)OC2=CC(=CC3=C2C(=O)NC4=CC=CC=C4O3)[N+](=O)[O-]

InChI

InChI=1S/C21H15N3O6/c1-12(25)22-13-5-4-6-15(9-13)29-18-10-14(24(27)28)11-19-20(18)21(26)23-16-7-2-3-8-17(16)30-19/h2-11H,1H3,(H,22,25)(H,23,26)