1-decyl-1,3-dimethyl-pyrrol-1-ium-2,5-dione

Systemtic Name: 1-decyl-1,3-dimethyl-pyrrol-1-ium-2,5-dione Openeye Name: 1-decyl-1,3-dimethyl-pyrrol-1-ium-2,5-dione CAS Name: 1-decyl-1,3-dimethylpyrrol-1-ium-2,5-dione IUPAC Name: 1-decyl-1,3-dimethylpyrrol-1-ium-2,5-dione Traditional Name: 1-decyl-1,3-dimethyl-3-pyrrolin-1-ium-2,5-quinone Formula: C16H28NO2+ MolecularWeight: 266.39902

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC[N+]1(C(=O)C=C(C1=O)C)C

Isomeric SMILES

CCCCCCCCCC[N+]1(C(=O)C=C(C1=O)C)C

InChI

InChI=1S/C16H28NO2/c1-4-5-6-7-8-9-10-11-12-17(3)15(18)13-14(2)16(17)19/h13H,4-12H2,1-3H3/q+1