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

Systemtic Name: N-cyclopropyl-4-methoxy-2-[1-(pyridin-4-ylmethyl)piperidin-1-ium-4-yl]oxy-benzamide Openeye Name: N-cyclopropyl-4-methoxy-2-[1-(4-pyridylmethyl)piperidin-1-ium-4-yl]oxy-benzamide CAS Name: N-cyclopropyl-4-methoxy-2-[[1-(pyridin-4-ylmethyl)-4-piperidin-1-iumyl]oxy]benzamide IUPAC Name: N-cyclopropyl-4-methoxy-2-[1-(pyridin-4-ylmethyl)piperidin-1-ium-4-yl]oxybenzamide Traditional Name: N-cyclopropyl-4-methoxy-2-[1-(4-pyridylmethyl)piperidin-1-ium-4-yl]oxy-benzamide Formula: C22H28N3O3+ MolecularWeight: 382.47602

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3O3/c1-27-19-4-5-20(22(26)24-17-2-3-17)21(14-19)28-18-8-12-25(13-9-18)15-16-6-10-23-11-7-16/h4-7,10-11,14,17-18H,2-3,8-9,12-13,15H2,1H3,(H,24,26)/p+1