2-(4-chlorophenyl)-4-[[(2S)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]methyl]-1,3-oxazole

Systemtic Name: 2-(4-chlorophenyl)-4-[[(2S)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]methyl]-1,3-oxazole Openeye Name: 2-(4-chlorophenyl)-4-[[(2S)-2-(2-thienyl)pyrrolidin-1-ium-1-yl]methyl]oxazole CAS Name: 2-(4-chlorophenyl)-4-[[(2S)-2-thiophen-2-yl-1-pyrrolidin-1-iumyl]methyl]oxazole IUPAC Name: 2-(4-chlorophenyl)-4-[[(2S)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]methyl]-1,3-oxazole Traditional Name: 2-(4-chlorophenyl)-4-[[(2S)-2-(2-thienyl)pyrrolidin-1-ium-1-yl]methyl]oxazole Formula: C18H18ClN2OS+ MolecularWeight: 345.86632

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Descriptors Computed from Structure

Canonical SMILES:

C1CC([NH+](C1)CC2=COC(=N2)C3=CC=C(C=C3)Cl)C4=CC=CS4

Isomeric SMILES

C1C[C@H]([NH+](C1)CC2=COC(=N2)C3=CC=C(C=C3)Cl)C4=CC=CS4

InChI

InChI=1S/C18H17ClN2OS/c19-14-7-5-13(6-8-14)18-20-15(12-22-18)11-21-9-1-3-16(21)17-4-2-10-23-17/h2,4-8,10,12,16H,1,3,9,11H2/p+1/t16-/m0/s1