2-cyclopentyl-1-[(3S)-3-[[4-(thiomorpholin-4-ium-4-ylmethyl)phenoxy]methyl]piperidin-1-yl]ethanone

Systemtic Name: 2-cyclopentyl-1-[(3S)-3-[[4-(thiomorpholin-4-ium-4-ylmethyl)phenoxy]methyl]piperidin-1-yl]ethanone Openeye Name: 2-cyclopentyl-1-[(3S)-3-[[4-(thiomorpholin-4-ium-4-ylmethyl)phenoxy]methyl]-1-piperidyl]ethanone CAS Name: 2-cyclopentyl-1-[(3S)-3-[[4-(4-thiomorpholin-4-iumylmethyl)phenoxy]methyl]-1-piperidinyl]ethanone IUPAC Name: 2-cyclopentyl-1-[(3S)-3-[[4-(thiomorpholin-4-ium-4-ylmethyl)phenoxy]methyl]piperidin-1-yl]ethanone Traditional Name: 2-cyclopentyl-1-[(3S)-3-[[4-(thiomorpholin-4-ium-4-ylmethyl)phenoxy]methyl]piperidino]ethanone Formula: C24H37N2O2S+ MolecularWeight: 417.62778

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)CC(=O)N2CCCC(C2)COC3=CC=C(C=C3)C[NH+]4CCSCC4

Isomeric SMILES

C1CCC(C1)CC(=O)N2CCC[C@@H](C2)COC3=CC=C(C=C3)C[NH+]4CCSCC4

InChI

InChI=1S/C24H36N2O2S/c27-24(16-20-4-1-2-5-20)26-11-3-6-22(18-26)19-28-23-9-7-21(8-10-23)17-25-12-14-29-15-13-25/h7-10,20,22H,1-6,11-19H2/p+1/t22-/m0/s1