N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[1-(pyridin-4-ylmethyl)piperidin-1-ium-4-yl]propanamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[1-(pyridin-4-ylmethyl)piperidin-1-ium-4-yl]propanamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[1-(4-pyridylmethyl)piperidin-1-ium-4-yl]propanamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[1-(pyridin-4-ylmethyl)-4-piperidin-1-iumyl]propanamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[1-(pyridin-4-ylmethyl)piperidin-1-ium-4-yl]propanamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[1-(4-pyridylmethyl)piperidin-1-ium-4-yl]propionamide Formula: C22H28N3O3+ MolecularWeight: 382.47602

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1CCC(=O)NC2=CC3=C(C=C2)OCCO3)CC4=CC=NC=C4

Isomeric SMILES

C1C[NH+](CCC1CCC(=O)NC2=CC3=C(C=C2)OCCO3)CC4=CC=NC=C4

InChI

InChI=1S/C22H27N3O3/c26-22(24-19-2-3-20-21(15-19)28-14-13-27-20)4-1-17-7-11-25(12-8-17)16-18-5-9-23-10-6-18/h2-3,5-6,9-10,15,17H,1,4,7-8,11-14,16H2,(H,24,26)/p+1