5-[[(3R)-3-(2,5-dimethoxyphenyl)pyrrolidin-1-ium-1-yl]methyl]-3-thiophen-2-yl-1,2,4-oxadiazole

Systemtic Name: 5-[[(3R)-3-(2,5-dimethoxyphenyl)pyrrolidin-1-ium-1-yl]methyl]-3-thiophen-2-yl-1,2,4-oxadiazole Openeye Name: 5-[[(3R)-3-(2,5-dimethoxyphenyl)pyrrolidin-1-ium-1-yl]methyl]-3-(2-thienyl)-1,2,4-oxadiazole CAS Name: 5-[[(3R)-3-(2,5-dimethoxyphenyl)-1-pyrrolidin-1-iumyl]methyl]-3-thiophen-2-yl-1,2,4-oxadiazole IUPAC Name: 5-[[(3R)-3-(2,5-dimethoxyphenyl)pyrrolidin-1-ium-1-yl]methyl]-3-thiophen-2-yl-1,2,4-oxadiazole Traditional Name: 5-[[(3R)-3-(2,5-dimethoxyphenyl)pyrrolidin-1-ium-1-yl]methyl]-3-(2-thienyl)-1,2,4-oxadiazole Formula: C19H22N3O3S+ MolecularWeight: 372.46128

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C2CC[NH+](C2)CC3=NC(=NO3)C4=CC=CS4

Isomeric SMILES

COC1=CC(=C(C=C1)OC)[C@H]2CC[NH+](C2)CC3=NC(=NO3)C4=CC=CS4

InChI

InChI=1S/C19H21N3O3S/c1-23-14-5-6-16(24-2)15(10-14)13-7-8-22(11-13)12-18-20-19(21-25-18)17-4-3-9-26-17/h3-6,9-10,13H,7-8,11-12H2,1-2H3/p+1/t13-/m0/s1