7-(4-methoxyphenoxy)-2-methyl-9-nitro-5H-benzo[b][1,4]benzoxazepin-6-one

Systemtic Name: 7-(4-methoxyphenoxy)-2-methyl-9-nitro-5H-benzo[b][1,4]benzoxazepin-6-one Openeye Name: 7-(4-methoxyphenoxy)-2-methyl-9-nitro-5H-benzo[b][1,4]benzoxazepin-6-one CAS Name: 7-(4-methoxyphenoxy)-2-methyl-9-nitro-5H-benzo[b][1,4]benzoxazepin-6-one IUPAC Name: 7-(4-methoxyphenoxy)-2-methyl-9-nitro-5H-benzo[b][1,4]benzoxazepin-6-one Traditional Name: 7-(4-methoxyphenoxy)-2-methyl-9-nitro-5H-benzo[b][1,4]benzoxazepin-6-one Formula: C21H16N2O6 MolecularWeight: 392.36154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=O)C3=C(O2)C=C(C=C3OC4=CC=C(C=C4)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=O)C3=C(O2)C=C(C=C3OC4=CC=C(C=C4)OC)[N+](=O)[O-]

InChI

InChI=1S/C21H16N2O6/c1-12-3-8-16-17(9-12)29-19-11-13(23(25)26)10-18(20(19)21(24)22-16)28-15-6-4-14(27-2)5-7-15/h3-11H,1-2H3,(H,22,24)