1-(2,3-dihydro-1,4-benzoxazin-4-yl)-2-piperidin-1-ium-1-yl-ethanone chloride

Systemtic Name: 1-(2,3-dihydro-1,4-benzoxazin-4-yl)-2-piperidin-1-ium-1-yl-ethanone chloride Openeye Name: 1-(2,3-dihydro-1,4-benzoxazin-4-yl)-2-piperidin-1-ium-1-yl-ethanone chloride CAS Name: 1-(2,3-dihydro-1,4-benzoxazin-4-yl)-2-(1-piperidin-1-iumyl)ethanone chloride IUPAC Name: 1-(2,3-dihydro-1,4-benzoxazin-4-yl)-2-piperidin-1-ium-1-ylethanone chloride Traditional Name: 1-(2,3-dihydro-1,4-benzoxazin-4-yl)-2-piperidin-1-ium-1-yl-ethanone chloride Formula: C15H21ClN2O2 MolecularWeight: 296.79244

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC(=O)N2CCOC3=CC=CC=C32.[Cl-]

Isomeric SMILES

C1CC[NH+](CC1)CC(=O)N2CCOC3=CC=CC=C32.[Cl-]

InChI

InChI=1S/C15H20N2O2.ClH/c18-15(12-16-8-4-1-5-9-16)17-10-11-19-14-7-3-2-6-13(14)17;/h2-3,6-7H,1,4-5,8-12H2;1H