3-chloranyl-N-(2-methoxyethyl)-4-[1-[(3S)-thiolan-3-yl]piperidin-1-ium-4-yl]oxy-benzamide

Systemtic Name: 3-chloranyl-N-(2-methoxyethyl)-4-[1-[(3S)-thiolan-3-yl]piperidin-1-ium-4-yl]oxy-benzamide Openeye Name: 3-chloro-N-(2-methoxyethyl)-4-[1-[(3S)-tetrahydrothiophen-3-yl]piperidin-1-ium-4-yl]oxy-benzamide CAS Name: 3-chloro-N-(2-methoxyethyl)-4-[[1-[(3S)-3-thiolanyl]-4-piperidin-1-iumyl]oxy]benzamide IUPAC Name: 3-chloro-N-(2-methoxyethyl)-4-[1-[(3S)-thiolan-3-yl]piperidin-1-ium-4-yl]oxybenzamide Traditional Name: 3-chloro-N-(2-methoxyethyl)-4-[1-[(3S)-tetrahydrothiophen-3-yl]piperidin-1-ium-4-yl]oxy-benzamide Formula: C19H28ClN2O3S+ MolecularWeight: 399.95522

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC(=O)C1=CC(=C(C=C1)OC2CC[NH+](CC2)C3CCSC3)Cl

Isomeric SMILES

COCCNC(=O)C1=CC(=C(C=C1)OC2CC[NH+](CC2)[C@H]3CCSC3)Cl

InChI

InChI=1S/C19H27ClN2O3S/c1-24-10-7-21-19(23)14-2-3-18(17(20)12-14)25-16-4-8-22(9-5-16)15-6-11-26-13-15/h2-3,12,15-16H,4-11,13H2,1H3,(H,21,23)/p+1/t15-/m0/s1