5-[(4-methoxyphenyl)methyl]-9-nitro-benzo[b][1,4]benzoxazepin-6-one

Systemtic Name: 5-[(4-methoxyphenyl)methyl]-9-nitro-benzo[b][1,4]benzoxazepin-6-one Openeye Name: 5-[(4-methoxyphenyl)methyl]-9-nitro-benzo[b][1,4]benzoxazepin-6-one CAS Name: 5-[(4-methoxyphenyl)methyl]-9-nitro-6-benzo[b][1,4]benzoxazepinone IUPAC Name: 5-[(4-methoxyphenyl)methyl]-9-nitrobenzo[b][1,4]benzoxazepin-6-one Traditional Name: 9-nitro-5-p-anisyl-benzo[b][1,4]benzoxazepin-6-one Formula: C21H16N2O5 MolecularWeight: 376.36214

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2C3=CC=CC=C3OC4=C(C2=O)C=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)CN2C3=CC=CC=C3OC4=C(C2=O)C=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H16N2O5/c1-27-16-9-6-14(7-10-16)13-22-18-4-2-3-5-19(18)28-20-12-15(23(25)26)8-11-17(20)21(22)24/h2-12H,13H2,1H3