(5S)-4-methyl-4-oxidanidyl-5-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-ium

Systemtic Name: (5S)-4-methyl-4-oxidanidyl-5-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-ium Openeye Name: (5S)-4-methyl-4-oxido-5-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-ium CAS Name: (5S)-4-methyl-4-oxido-5-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-ium IUPAC Name: (5S)-4-methyl-4-oxido-5-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-ium Traditional Name: (5S)-4-methyl-4-oxido-5-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-ium Formula: C16H17NO2 MolecularWeight: 255.31168

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCOC2=CC=CC=C2C1C3=CC=CC=C3)[O-]

Isomeric SMILES

C[N+]1(CCOC2=CC=CC=C2[C@@H]1C3=CC=CC=C3)[O-]

InChI

InChI=1S/C16H17NO2/c1-17(18)11-12-19-15-10-6-5-9-14(15)16(17)13-7-3-2-4-8-13/h2-10,16H,11-12H2,1H3/t16-,17?/m0/s1