6-ethyl-6-[4-(phenoxymethyl)phenyl]pyrrolo[2,1-d][1,5]benzoxazepin-7-one

Systemtic Name: 6-ethyl-6-[4-(phenoxymethyl)phenyl]pyrrolo[2,1-d][1,5]benzoxazepin-7-one Openeye Name: 6-ethyl-6-[4-(phenoxymethyl)phenyl]pyrrolo[2,1-d][1,5]benzoxazepin-7-one CAS Name: 6-ethyl-6-[4-(phenoxymethyl)phenyl]-7-pyrrolo[2,1-d][1,5]benzoxazepinone IUPAC Name: 6-ethyl-6-[4-(phenoxymethyl)phenyl]pyrrolo[2,1-d][1,5]benzoxazepin-7-one Traditional Name: 6-ethyl-6-[4-(phenoxymethyl)phenyl]pyrrolo[2,1-d][1,5]benzoxazepin-7-one Formula: C27H23NO3 MolecularWeight: 409.47642

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(=O)C2=CC=CN2C3=CC=CC=C3O1)C4=CC=C(C=C4)COC5=CC=CC=C5

Isomeric SMILES

CCC1(C(=O)C2=CC=CN2C3=CC=CC=C3O1)C4=CC=C(C=C4)COC5=CC=CC=C5

InChI

InChI=1S/C27H23NO3/c1-2-27(21-16-14-20(15-17-21)19-30-22-9-4-3-5-10-22)26(29)24-12-8-18-28(24)23-11-6-7-13-25(23)31-27/h3-18H,2,19H2,1H3