3-[1-[(2-chloranyl-4-fluoranyl-phenyl)methyl]piperidin-1-ium-4-yl]oxy-N-cyclopropyl-4-methoxy-benzamide

Systemtic Name: 3-[1-[(2-chloranyl-4-fluoranyl-phenyl)methyl]piperidin-1-ium-4-yl]oxy-N-cyclopropyl-4-methoxy-benzamide Openeye Name: 3-[1-[(2-chloro-4-fluoro-phenyl)methyl]piperidin-1-ium-4-yl]oxy-N-cyclopropyl-4-methoxy-benzamide CAS Name: 3-[[1-[(2-chloro-4-fluorophenyl)methyl]-4-piperidin-1-iumyl]oxy]-N-cyclopropyl-4-methoxybenzamide IUPAC Name: 3-[1-[(2-chloro-4-fluorophenyl)methyl]piperidin-1-ium-4-yl]oxy-N-cyclopropyl-4-methoxybenzamide Traditional Name: 3-[1-(2-chloro-4-fluoro-benzyl)piperidin-1-ium-4-yl]oxy-N-cyclopropyl-4-methoxy-benzamide Formula: C23H27ClFN2O3+ MolecularWeight: 433.923483

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2CC2)OC3CC[NH+](CC3)CC4=C(C=C(C=C4)F)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2CC2)OC3CC[NH+](CC3)CC4=C(C=C(C=C4)F)Cl

InChI

InChI=1S/C23H26ClFN2O3/c1-29-21-7-3-15(23(28)26-18-5-6-18)12-22(21)30-19-8-10-27(11-9-19)14-16-2-4-17(25)13-20(16)24/h2-4,7,12-13,18-19H,5-6,8-11,14H2,1H3,(H,26,28)/p+1