5-butyl-7-methoxy-9-nitro-benzo[b][1,4]benzoxazepin-6-one

Systemtic Name: 5-butyl-7-methoxy-9-nitro-benzo[b][1,4]benzoxazepin-6-one Openeye Name: 5-butyl-7-methoxy-9-nitro-benzo[b][1,4]benzoxazepin-6-one CAS Name: 5-butyl-7-methoxy-9-nitro-6-benzo[b][1,4]benzoxazepinone IUPAC Name: 5-butyl-7-methoxy-9-nitrobenzo[b][1,4]benzoxazepin-6-one Traditional Name: 5-butyl-7-methoxy-9-nitro-benzo[b][1,4]benzoxazepin-6-one Formula: C18H18N2O5 MolecularWeight: 342.34592

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=CC=CC=C2OC3=C(C1=O)C(=CC(=C3)[N+](=O)[O-])OC

Isomeric SMILES

CCCCN1C2=CC=CC=C2OC3=C(C1=O)C(=CC(=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C18H18N2O5/c1-3-4-9-19-13-7-5-6-8-14(13)25-16-11-12(20(22)23)10-15(24-2)17(16)18(19)21/h5-8,10-11H,3-4,9H2,1-2H3