2-[5-chloranyl-1,3-bis(oxidanylidene)-3a,4,7,7a-tetrahydroisoindol-2-yl]ethyl-trimethyl-azanium

Systemtic Name: 2-[5-chloranyl-1,3-bis(oxidanylidene)-3a,4,7,7a-tetrahydroisoindol-2-yl]ethyl-trimethyl-azanium Openeye Name: 2-(5-chloro-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)ethyl-trimethyl-ammonium CAS Name: 2-(5-chloro-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)ethyl-trimethylammonium IUPAC Name: 2-(5-chloro-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)ethyl-trimethylazanium Traditional Name: 2-(5-chloro-1,3-diketo-3a,4,7,7a-tetrahydroisoindol-2-yl)ethyl-trimethyl-ammonium Formula: C13H20ClN2O2+ MolecularWeight: 271.7631

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CCN1C(=O)C2CC=C(CC2C1=O)Cl

Isomeric SMILES

C[N+](C)(C)CCN1C(=O)C2CC=C(CC2C1=O)Cl

InChI

InChI=1S/C13H20ClN2O2/c1-16(2,3)7-6-15-12(17)10-5-4-9(14)8-11(10)13(15)18/h4,10-11H,5-8H2,1-3H3/q+1