(1,1-dimethylpyrrolidin-1-ium-2-yl) 2-(4-cyclopentyl-3-oxidanyl-thiophen-2-yl)ethanoate

Systemtic Name: (1,1-dimethylpyrrolidin-1-ium-2-yl) 2-(4-cyclopentyl-3-oxidanyl-thiophen-2-yl)ethanoate Openeye Name: (1,1-dimethylpyrrolidin-1-ium-2-yl) 2-(4-cyclopentyl-3-hydroxy-2-thienyl)acetate CAS Name: 2-(4-cyclopentyl-3-hydroxy-2-thiophenyl)acetic acid (1,1-dimethyl-2-pyrrolidin-1-iumyl) ester IUPAC Name: (1,1-dimethylpyrrolidin-1-ium-2-yl) 2-(4-cyclopentyl-3-hydroxythiophen-2-yl)acetate Traditional Name: 2-(4-cyclopentyl-3-hydroxy-2-thienyl)acetic acid (1,1-dimethylpyrrolidin-1-ium-2-yl) ester Formula: C17H26NO3S+ MolecularWeight: 324.45824

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCCC1OC(=O)CC2=C(C(=CS2)C3CCCC3)O)C

Isomeric SMILES

C[N+]1(CCCC1OC(=O)CC2=C(C(=CS2)C3CCCC3)O)C

InChI

InChI=1S/C17H25NO3S/c1-18(2)9-5-8-15(18)21-16(19)10-14-17(20)13(11-22-14)12-6-3-4-7-12/h11-12,15H,3-10H2,1-2H3/p+1