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

Systemtic Name: 6-ethyl-6-[4-(phenylazanylmethyl)phenyl]pyrrolo[2,1-d][1,5]benzoxazepin-7-one Openeye Name: 6-[4-(anilinomethyl)phenyl]-6-ethyl-pyrrolo[2,1-d][1,5]benzoxazepin-7-one CAS Name: 6-[4-(anilinomethyl)phenyl]-6-ethyl-7-pyrrolo[2,1-d][1,5]benzoxazepinone IUPAC Name: 6-[4-(anilinomethyl)phenyl]-6-ethylpyrrolo[2,1-d][1,5]benzoxazepin-7-one Traditional Name: 6-[4-(anilinomethyl)phenyl]-6-ethyl-pyrrolo[2,1-d][1,5]benzoxazepin-7-one Formula: C27H24N2O2 MolecularWeight: 408.49166

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(=O)C2=CC=CN2C3=CC=CC=C3O1)C4=CC=C(C=C4)CNC5=CC=CC=C5

Isomeric SMILES

CCC1(C(=O)C2=CC=CN2C3=CC=CC=C3O1)C4=CC=C(C=C4)CNC5=CC=CC=C5

InChI

InChI=1S/C27H24N2O2/c1-2-27(21-16-14-20(15-17-21)19-28-22-9-4-3-5-10-22)26(30)24-12-8-18-29(24)23-11-6-7-13-25(23)31-27/h3-18,28H,2,19H2,1H3