N-(phenylmethyl)-3-[1-[(2R)-1-pyridin-3-ylpropan-2-yl]piperidin-1-ium-4-yl]oxy-benzamide

Systemtic Name: N-(phenylmethyl)-3-[1-[(2R)-1-pyridin-3-ylpropan-2-yl]piperidin-1-ium-4-yl]oxy-benzamide Openeye Name: N-benzyl-3-[1-[(1R)-1-methyl-2-(3-pyridyl)ethyl]piperidin-1-ium-4-yl]oxy-benzamide CAS Name: N-(phenylmethyl)-3-[[1-[(2R)-1-(3-pyridinyl)propan-2-yl]-4-piperidin-1-iumyl]oxy]benzamide IUPAC Name: N-benzyl-3-[1-[(2R)-1-pyridin-3-ylpropan-2-yl]piperidin-1-ium-4-yl]oxybenzamide Traditional Name: N-benzyl-3-[1-[(1R)-1-methyl-2-(3-pyridyl)ethyl]piperidin-1-ium-4-yl]oxy-benzamide Formula: C27H32N3O2+ MolecularWeight: 430.56188

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CN=CC=C1)[NH+]2CCC(CC2)OC3=CC=CC(=C3)C(=O)NCC4=CC=CC=C4

Isomeric SMILES

C[C@H](CC1=CN=CC=C1)[NH+]2CCC(CC2)OC3=CC=CC(=C3)C(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C27H31N3O2/c1-21(17-23-9-6-14-28-19-23)30-15-12-25(13-16-30)32-26-11-5-10-24(18-26)27(31)29-20-22-7-3-2-4-8-22/h2-11,14,18-19,21,25H,12-13,15-17,20H2,1H3,(H,29,31)/p+1/t21-/m1/s1