N-methyl-N-(2-phenoxyethyl)-4-[1-(pyridin-2-ylmethyl)piperidin-1-ium-4-yl]oxy-benzamide

Systemtic Name: N-methyl-N-(2-phenoxyethyl)-4-[1-(pyridin-2-ylmethyl)piperidin-1-ium-4-yl]oxy-benzamide Openeye Name: N-methyl-N-(2-phenoxyethyl)-4-[1-(2-pyridylmethyl)piperidin-1-ium-4-yl]oxy-benzamide CAS Name: N-methyl-N-(2-phenoxyethyl)-4-[[1-(2-pyridinylmethyl)-4-piperidin-1-iumyl]oxy]benzamide IUPAC Name: N-methyl-N-(2-phenoxyethyl)-4-[1-(pyridin-2-ylmethyl)piperidin-1-ium-4-yl]oxybenzamide Traditional Name: N-methyl-N-(2-phenoxyethyl)-4-[1-(2-pyridylmethyl)piperidin-1-ium-4-yl]oxy-benzamide Formula: C27H32N3O3+ MolecularWeight: 446.56128

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCOC1=CC=CC=C1)C(=O)C2=CC=C(C=C2)OC3CC[NH+](CC3)CC4=CC=CC=N4

Isomeric SMILES

CN(CCOC1=CC=CC=C1)C(=O)C2=CC=C(C=C2)OC3CC[NH+](CC3)CC4=CC=CC=N4

InChI

InChI=1S/C27H31N3O3/c1-29(19-20-32-24-8-3-2-4-9-24)27(31)22-10-12-25(13-11-22)33-26-14-17-30(18-15-26)21-23-7-5-6-16-28-23/h2-13,16,26H,14-15,17-21H2,1H3/p+1