1-(1,3-benzodioxol-5-yl)-3-morpholin-4-ium-4-yl-propan-1-one chloride

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-morpholin-4-ium-4-yl-propan-1-one chloride Openeye Name: 1-(1,3-benzodioxol-5-yl)-3-morpholin-4-ium-4-yl-propan-1-one chloride CAS Name: 1-(1,3-benzodioxol-5-yl)-3-(4-morpholin-4-iumyl)-1-propanone chloride IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-morpholin-4-ium-4-ylpropan-1-one chloride Traditional Name: 1-(1,3-benzodioxol-5-yl)-3-morpholin-4-ium-4-yl-propan-1-one chloride Formula: C14H18ClNO4 MolecularWeight: 299.75002

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCC(=O)C2=CC3=C(C=C2)OCO3.[Cl-]

Isomeric SMILES

C1COCC[NH+]1CCC(=O)C2=CC3=C(C=C2)OCO3.[Cl-]

InChI

InChI=1S/C14H17NO4.ClH/c16-12(3-4-15-5-7-17-8-6-15)11-1-2-13-14(9-11)19-10-18-13;/h1-2,9H,3-8,10H2;1H