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

Systemtic Name: 9-(3-methylphenoxy)-7-nitro-5H-benzo[b][1,4]benzoxazepin-6-one Openeye Name: 9-(3-methylphenoxy)-7-nitro-5H-benzo[b][1,4]benzoxazepin-6-one CAS Name: 9-(3-methylphenoxy)-7-nitro-5H-benzo[b][1,4]benzoxazepin-6-one IUPAC Name: 9-(3-methylphenoxy)-7-nitro-5H-benzo[b][1,4]benzoxazepin-6-one Traditional Name: 9-(3-methylphenoxy)-7-nitro-5H-benzo[b][1,4]benzoxazepin-6-one Formula: C20H14N2O5 MolecularWeight: 362.33556

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OC2=CC3=C(C(=C2)[N+](=O)[O-])C(=O)NC4=CC=CC=C4O3

Isomeric SMILES

CC1=CC(=CC=C1)OC2=CC3=C(C(=C2)[N+](=O)[O-])C(=O)NC4=CC=CC=C4O3

InChI

InChI=1S/C20H14N2O5/c1-12-5-4-6-13(9-12)26-14-10-16(22(24)25)19-18(11-14)27-17-8-3-2-7-15(17)21-20(19)23/h2-11H,1H3,(H,21,23)