[1-(3-phenoxypropyl)-1-azoniabicyclo[2.2.2]octan-4-yl] 2-thiophen-2-yl-2-thiophen-3-yl-ethanoate

Systemtic Name: [1-(3-phenoxypropyl)-1-azoniabicyclo[2.2.2]octan-4-yl] 2-thiophen-2-yl-2-thiophen-3-yl-ethanoate Openeye Name: [1-(3-phenoxypropyl)quinuclidin-1-ium-4-yl] 2-(2-thienyl)-2-(3-thienyl)acetate CAS Name: 2-thiophen-2-yl-2-(3-thiophenyl)acetic acid [1-(3-phenoxypropyl)-1-azoniabicyclo[2.2.2]octan-4-yl] ester IUPAC Name: [1-(3-phenoxypropyl)-1-azoniabicyclo[2.2.2]octan-4-yl] 2-thiophen-2-yl-2-thiophen-3-ylacetate Traditional Name: 2-(2-thienyl)-2-(3-thienyl)acetic acid [1-(3-phenoxypropyl)quinuclidin-1-ium-4-yl] ester Formula: C26H30NO3S2+ MolecularWeight: 468.6513

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Descriptors Computed from Structure

Canonical SMILES:

C1C[N+]2(CCC1(CC2)OC(=O)C(C3=CSC=C3)C4=CC=CS4)CCCOC5=CC=CC=C5

Isomeric SMILES

C1C[N+]2(CCC1(CC2)OC(=O)C(C3=CSC=C3)C4=CC=CS4)CCCOC5=CC=CC=C5

InChI

InChI=1S/C26H30NO3S2/c28-25(24(21-9-19-31-20-21)23-8-4-18-32-23)30-26-10-14-27(15-11-26,16-12-26)13-5-17-29-22-6-2-1-3-7-22/h1-4,6-9,18-20,24H,5,10-17H2/q+1