2-(benzotriazol-2-yl)-1-[(2S)-2-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethanone

Systemtic Name: 2-(benzotriazol-2-yl)-1-[(2S)-2-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethanone Openeye Name: 2-(benzotriazol-2-yl)-1-[(2S)-2-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethanone CAS Name: 2-(2-benzotriazolyl)-1-[(2S)-2-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethanone IUPAC Name: 2-(benzotriazol-2-yl)-1-[(2S)-2-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethanone Traditional Name: 2-(benzotriazol-2-yl)-1-[(2S)-2-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethanone Formula: C23H20N4O2 MolecularWeight: 384.4305

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2CN1C(=O)CN3N=C4C=CC=CC4=N3)C5=CC=CC=C5

Isomeric SMILES

C1[C@@H](OC2=CC=CC=C2CN1C(=O)CN3N=C4C=CC=CC4=N3)C5=CC=CC=C5

InChI

InChI=1S/C23H20N4O2/c28-23(16-27-24-19-11-5-6-12-20(19)25-27)26-14-18-10-4-7-13-21(18)29-22(15-26)17-8-2-1-3-9-17/h1-13,22H,14-16H2/t22-/m1/s1