3-chloranyl-N-cyclopentyl-4-[1-(thiophen-3-ylmethyl)piperidin-1-ium-4-yl]oxy-benzamide

Systemtic Name: 3-chloranyl-N-cyclopentyl-4-[1-(thiophen-3-ylmethyl)piperidin-1-ium-4-yl]oxy-benzamide Openeye Name: 3-chloro-N-cyclopentyl-4-[1-(3-thienylmethyl)piperidin-1-ium-4-yl]oxy-benzamide CAS Name: 3-chloro-N-cyclopentyl-4-[[1-(3-thiophenylmethyl)-4-piperidin-1-iumyl]oxy]benzamide IUPAC Name: 3-chloro-N-cyclopentyl-4-[1-(thiophen-3-ylmethyl)piperidin-1-ium-4-yl]oxybenzamide Traditional Name: 3-chloro-N-cyclopentyl-4-[1-(3-thenyl)piperidin-1-ium-4-yl]oxy-benzamide Formula: C22H28ClN2O2S+ MolecularWeight: 419.98792

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=O)C2=CC(=C(C=C2)OC3CC[NH+](CC3)CC4=CSC=C4)Cl

Isomeric SMILES

C1CCC(C1)NC(=O)C2=CC(=C(C=C2)OC3CC[NH+](CC3)CC4=CSC=C4)Cl

InChI

InChI=1S/C22H27ClN2O2S/c23-20-13-17(22(26)24-18-3-1-2-4-18)5-6-21(20)27-19-7-10-25(11-8-19)14-16-9-12-28-15-16/h5-6,9,12-13,15,18-19H,1-4,7-8,10-11,14H2,(H,24,26)/p+1