7-chloranyl-4-methyl-4-oxidanidyl-5-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-ium

Systemtic Name: 7-chloranyl-4-methyl-4-oxidanidyl-5-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-ium Openeye Name: 7-chloro-4-methyl-4-oxido-5-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-ium CAS Name: 7-chloro-4-methyl-4-oxido-5-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-ium IUPAC Name: 7-chloro-4-methyl-4-oxido-5-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-ium Traditional Name: 7-chloro-4-methyl-4-oxido-5-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-ium Formula: C16H16ClNO2 MolecularWeight: 289.75674

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCOC2=C(C1C3=CC=CC=C3)C=C(C=C2)Cl)[O-]

Isomeric SMILES

C[N+]1(CCOC2=C(C1C3=CC=CC=C3)C=C(C=C2)Cl)[O-]

InChI

InChI=1S/C16H16ClNO2/c1-18(19)9-10-20-15-8-7-13(17)11-14(15)16(18)12-5-3-2-4-6-12/h2-8,11,16H,9-10H2,1H3