N-[(3S)-oxolan-3-yl]-2-[1-(pyridin-2-ylmethyl)piperidin-1-ium-4-yl]oxy-benzamide

Systemtic Name: N-[(3S)-oxolan-3-yl]-2-[1-(pyridin-2-ylmethyl)piperidin-1-ium-4-yl]oxy-benzamide Openeye Name: 2-[1-(2-pyridylmethyl)piperidin-1-ium-4-yl]oxy-N-[(3S)-tetrahydrofuran-3-yl]benzamide CAS Name: N-[(3S)-3-oxolanyl]-2-[[1-(2-pyridinylmethyl)-4-piperidin-1-iumyl]oxy]benzamide IUPAC Name: N-[(3S)-oxolan-3-yl]-2-[1-(pyridin-2-ylmethyl)piperidin-1-ium-4-yl]oxybenzamide Traditional Name: 2-[1-(2-pyridylmethyl)piperidin-1-ium-4-yl]oxy-N-[(3S)-tetrahydrofuran-3-yl]benzamide Formula: C22H28N3O3+ MolecularWeight: 382.47602

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1OC2=CC=CC=C2C(=O)NC3CCOC3)CC4=CC=CC=N4

Isomeric SMILES

C1COC[C@H]1NC(=O)C2=CC=CC=C2OC3CC[NH+](CC3)CC4=CC=CC=N4

InChI

InChI=1S/C22H27N3O3/c26-22(24-18-10-14-27-16-18)20-6-1-2-7-21(20)28-19-8-12-25(13-9-19)15-17-5-3-4-11-23-17/h1-7,11,18-19H,8-10,12-16H2,(H,24,26)/p+1/t18-/m0/s1