1-adamantyl-[2-(4-chlorophenyl)-2-oxidanyl-propyl]azanium chloride

Systemtic Name: 1-adamantyl-[2-(4-chlorophenyl)-2-oxidanyl-propyl]azanium chloride Openeye Name: 1-adamantyl-[2-(4-chlorophenyl)-2-hydroxy-propyl]ammonium chloride CAS Name: 1-adamantyl-[2-(4-chlorophenyl)-2-hydroxypropyl]ammonium chloride IUPAC Name: 1-adamantyl-[2-(4-chlorophenyl)-2-hydroxypropyl]azanium chloride Traditional Name: 1-adamantyl-[2-(4-chlorophenyl)-2-hydroxy-propyl]ammonium chloride Formula: C19H27Cl2NO MolecularWeight: 356.32978

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Descriptors Computed from Structure

Canonical SMILES:

CC(C[NH2+]C12CC3CC(C1)CC(C3)C2)(C4=CC=C(C=C4)Cl)O.[Cl-]

Isomeric SMILES

CC(C[NH2+]C12CC3CC(C1)CC(C3)C2)(C4=CC=C(C=C4)Cl)O.[Cl-]

InChI

InChI=1S/C19H26ClNO.ClH/c1-18(22,16-2-4-17(20)5-3-16)12-21-19-9-13-6-14(10-19)8-15(7-13)11-19;/h2-5,13-15,21-22H,6-12H2,1H3;1H