1-[5-(1-oxidanidylpyrrolidin-1-ium-1-yl)pent-3-ynyl]pyrrolidine-2,5-dione

Systemtic Name: 1-[5-(1-oxidanidylpyrrolidin-1-ium-1-yl)pent-3-ynyl]pyrrolidine-2,5-dione Openeye Name: 1-[5-(1-oxidopyrrolidin-1-ium-1-yl)pent-3-ynyl]pyrrolidine-2,5-dione CAS Name: 1-[5-(1-oxido-1-pyrrolidin-1-iumyl)pent-3-ynyl]pyrrolidine-2,5-dione IUPAC Name: 1-[5-(1-oxidopyrrolidin-1-ium-1-yl)pent-3-ynyl]pyrrolidine-2,5-dione Traditional Name: 1-[5-(1-oxidopyrrolidin-1-ium-1-yl)pent-3-ynyl]pyrrolidine-2,5-quinone Formula: C13H18N2O3 MolecularWeight: 250.29362

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC[N+](C1)(CC#CCCN2C(=O)CCC2=O)[O-]

Isomeric SMILES

C1CC[N+](C1)(CC#CCCN2C(=O)CCC2=O)[O-]

InChI

InChI=1S/C13H18N2O3/c16-12-6-7-13(17)14(12)8-2-1-3-9-15(18)10-4-5-11-15/h2,4-11H2