2-(2-piperidin-1-ium-1-ylethyl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione chloride

Systemtic Name: 2-(2-piperidin-1-ium-1-ylethyl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione chloride Openeye Name: 2-(2-piperidin-1-ium-1-ylethyl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione chloride CAS Name: 2-[2-(1-piperidin-1-iumyl)ethyl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione chloride IUPAC Name: 2-(2-piperidin-1-ium-1-ylethyl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione chloride Traditional Name: 2-(2-piperidin-1-ium-1-ylethyl)-3a,4,7,7a-tetrahydroisoindole-1,3-quinone chloride Formula: C15H23ClN2O2 MolecularWeight: 298.80832

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCN2C(=O)C3CC=CCC3C2=O.[Cl-]

Isomeric SMILES

C1CC[NH+](CC1)CCN2C(=O)C3CC=CCC3C2=O.[Cl-]

InChI

InChI=1S/C15H22N2O2.ClH/c18-14-12-6-2-3-7-13(12)15(19)17(14)11-10-16-8-4-1-5-9-16;/h2-3,12-13H,1,4-11H2;1H