1-(4-pyridin-1-ium-2-ylpiperazin-1-yl)-2-[(2R)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]ethanone

Systemtic Name: 1-(4-pyridin-1-ium-2-ylpiperazin-1-yl)-2-[(2R)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]ethanone Openeye Name: 1-(4-pyridin-1-ium-2-ylpiperazin-1-yl)-2-[(2R)-2-(2-thienyl)pyrrolidin-1-ium-1-yl]ethanone CAS Name: 1-[4-(2-pyridin-1-iumyl)-1-piperazinyl]-2-[(2R)-2-thiophen-2-yl-1-pyrrolidin-1-iumyl]ethanone IUPAC Name: 1-(4-pyridin-1-ium-2-ylpiperazin-1-yl)-2-[(2R)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]ethanone Traditional Name: 1-(4-pyridin-1-ium-2-ylpiperazino)-2-[(2R)-2-(2-thienyl)pyrrolidin-1-ium-1-yl]ethanone Formula: C19H26N4OS+2 MolecularWeight: 358.50094

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Descriptors Computed from Structure

Canonical SMILES:

C1CC([NH+](C1)CC(=O)N2CCN(CC2)C3=CC=CC=[NH+]3)C4=CC=CS4

Isomeric SMILES

C1C[C@@H]([NH+](C1)CC(=O)N2CCN(CC2)C3=CC=CC=[NH+]3)C4=CC=CS4

InChI

InChI=1S/C19H24N4OS/c24-19(15-23-9-3-5-16(23)17-6-4-14-25-17)22-12-10-21(11-13-22)18-7-1-2-8-20-18/h1-2,4,6-8,14,16H,3,5,9-13,15H2/p+2/t16-/m1/s1