(8-chloranyl-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)-dimethyl-azanium chloride

Systemtic Name: (8-chloranyl-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)-dimethyl-azanium chloride Openeye Name: (8-chloro-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)-dimethyl-ammonium chloride CAS Name: (8-chloro-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)-dimethylammonium chloride IUPAC Name: (8-chloro-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)-dimethylazanium chloride Traditional Name: (8-chloro-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)-dimethyl-ammonium chloride Formula: C12H17Cl2NO MolecularWeight: 262.17548

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C1CCCOC2=C1C=CC(=C2)Cl.[Cl-]

Isomeric SMILES

C[NH+](C)C1CCCOC2=C1C=CC(=C2)Cl.[Cl-]

InChI

InChI=1S/C12H16ClNO.ClH/c1-14(2)11-4-3-7-15-12-8-9(13)5-6-10(11)12;/h5-6,8,11H,3-4,7H2,1-2H3;1H