[(3S)-1-azoniabicyclo[2.2.2]octan-3-yl]-dithiophen-2-yl-methanol

Systemtic Name: [(3S)-1-azoniabicyclo[2.2.2]octan-3-yl]-dithiophen-2-yl-methanol Openeye Name: [(3S)-quinuclidin-1-ium-3-yl]-bis(2-thienyl)methanol CAS Name: [(3S)-1-azoniabicyclo[2.2.2]octan-3-yl]-dithiophen-2-ylmethanol IUPAC Name: [(3S)-1-azoniabicyclo[2.2.2]octan-3-yl]-dithiophen-2-ylmethanol Traditional Name: [(3S)-quinuclidin-1-ium-3-yl]-bis(2-thienyl)methanol Formula: C16H20NOS2+ MolecularWeight: 306.4661

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+]2CCC1C(C2)C(C3=CC=CS3)(C4=CC=CS4)O

Isomeric SMILES

C1C[NH+]2CCC1[C@@H](C2)C(C3=CC=CS3)(C4=CC=CS4)O

InChI

InChI=1S/C16H19NOS2/c18-16(14-3-1-9-19-14,15-4-2-10-20-15)13-11-17-7-5-12(13)6-8-17/h1-4,9-10,12-13,18H,5-8,11H2/p+1/t13-/m1/s1