N-[1-(2,3-dihydro-1,4-benzodioxin-3-yl)ethyl]-2-oxidanyl-3-piperidin-1-ium-1-yl-propanamide chloride

Systemtic Name: N-[1-(2,3-dihydro-1,4-benzodioxin-3-yl)ethyl]-2-oxidanyl-3-piperidin-1-ium-1-yl-propanamide chloride Openeye Name: N-[1-(2,3-dihydro-1,4-benzodioxin-3-yl)ethyl]-2-hydroxy-3-piperidin-1-ium-1-yl-propanamide chloride CAS Name: N-[1-(2,3-dihydro-1,4-benzodioxin-3-yl)ethyl]-2-hydroxy-3-(1-piperidin-1-iumyl)propanamide chloride IUPAC Name: N-[1-(2,3-dihydro-1,4-benzodioxin-3-yl)ethyl]-2-hydroxy-3-piperidin-1-ium-1-ylpropanamide chloride Traditional Name: N-[1-(2,3-dihydro-1,4-benzodioxin-3-yl)ethyl]-2-hydroxy-3-piperidin-1-ium-1-yl-propionamide chloride Formula: C18H27ClN2O4 MolecularWeight: 370.87098

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1COC2=CC=CC=C2O1)NC(=O)C(C[NH+]3CCCCC3)O.[Cl-]

Isomeric SMILES

CC(C1COC2=CC=CC=C2O1)NC(=O)C(C[NH+]3CCCCC3)O.[Cl-]

InChI

InChI=1S/C18H26N2O4.ClH/c1-13(17-12-23-15-7-3-4-8-16(15)24-17)19-18(22)14(21)11-20-9-5-2-6-10-20;/h3-4,7-8,13-14,17,21H,2,5-6,9-12H2,1H3,(H,19,22);1H