6-[3-(bromomethyl)phenyl]-6-ethyl-pyrrolo[2,1-d][1,5]benzoxazepin-7-one

Systemtic Name: 6-[3-(bromomethyl)phenyl]-6-ethyl-pyrrolo[2,1-d][1,5]benzoxazepin-7-one Openeye Name: 6-[3-(bromomethyl)phenyl]-6-ethyl-pyrrolo[2,1-d][1,5]benzoxazepin-7-one CAS Name: 6-[3-(bromomethyl)phenyl]-6-ethyl-7-pyrrolo[2,1-d][1,5]benzoxazepinone IUPAC Name: 6-[3-(bromomethyl)phenyl]-6-ethylpyrrolo[2,1-d][1,5]benzoxazepin-7-one Traditional Name: 6-[3-(bromomethyl)phenyl]-6-ethyl-pyrrolo[2,1-d][1,5]benzoxazepin-7-one Formula: C21H18BrNO2 MolecularWeight: 396.27712

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(=O)C2=CC=CN2C3=CC=CC=C3O1)C4=CC(=CC=C4)CBr

Isomeric SMILES

CCC1(C(=O)C2=CC=CN2C3=CC=CC=C3O1)C4=CC(=CC=C4)CBr

InChI

InChI=1S/C21H18BrNO2/c1-2-21(16-8-5-7-15(13-16)14-22)20(24)18-10-6-12-23(18)17-9-3-4-11-19(17)25-21/h3-13H,2,14H2,1H3