5-[(4-fluorophenyl)methyl]-2-methyl-8-nitro-benzo[b][1,4]benzoxazepin-6-one

Systemtic Name: 5-[(4-fluorophenyl)methyl]-2-methyl-8-nitro-benzo[b][1,4]benzoxazepin-6-one Openeye Name: 5-[(4-fluorophenyl)methyl]-2-methyl-8-nitro-benzo[b][1,4]benzoxazepin-6-one CAS Name: 5-[(4-fluorophenyl)methyl]-2-methyl-8-nitro-6-benzo[b][1,4]benzoxazepinone IUPAC Name: 5-[(4-fluorophenyl)methyl]-2-methyl-8-nitrobenzo[b][1,4]benzoxazepin-6-one Traditional Name: 5-(4-fluorobenzyl)-2-methyl-8-nitro-benzo[b][1,4]benzoxazepin-6-one Formula: C21H15FN2O4 MolecularWeight: 378.353203

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=O)C3=C(O2)C=CC(=C3)[N+](=O)[O-])CC4=CC=C(C=C4)F

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=O)C3=C(O2)C=CC(=C3)[N+](=O)[O-])CC4=CC=C(C=C4)F

InChI

InChI=1S/C21H15FN2O4/c1-13-2-8-18-20(10-13)28-19-9-7-16(24(26)27)11-17(19)21(25)23(18)12-14-3-5-15(22)6-4-14/h2-11H,12H2,1H3