3-(phenothiazin-10-ylmethyl)-1-azabicyclo[2.2.2]octan-3-ol hydrate

Systemtic Name: 3-(phenothiazin-10-ylmethyl)-1-azabicyclo[2.2.2]octan-3-ol hydrate Openeye Name: 3-(phenothiazin-10-ylmethyl)quinuclidin-3-ol hydrate CAS Name: 3-(10-phenothiazinylmethyl)-1-azabicyclo[2.2.2]octan-3-ol hydrate IUPAC Name: 3-(phenothiazin-10-ylmethyl)-1-azabicyclo[2.2.2]octan-3-ol hydrate Traditional Name: 3-(phenothiazin-10-ylmethyl)quinuclidin-3-ol hydrate Formula: C20H24N2O2S MolecularWeight: 356.48176

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2CCC1C(C2)(CN3C4=CC=CC=C4SC5=CC=CC=C53)O.O

Isomeric SMILES

C1CN2CCC1C(C2)(CN3C4=CC=CC=C4SC5=CC=CC=C53)O.O

InChI

InChI=1S/C20H22N2OS.H2O/c23-20(13-21-11-9-15(20)10-12-21)14-22-16-5-1-3-7-18(16)24-19-8-4-2-6-17(19)22;/h1-8,15,23H,9-14H2;1H2