1-oxidanidyl-1-tetradec-2-ynoxy-pyrrolidin-1-ium-2,5-dione

Systemtic Name: 1-oxidanidyl-1-tetradec-2-ynoxy-pyrrolidin-1-ium-2,5-dione Openeye Name: 1-oxido-1-tetradec-2-ynoxy-pyrrolidin-1-ium-2,5-dione CAS Name: 1-oxido-1-tetradec-2-ynoxypyrrolidin-1-ium-2,5-dione IUPAC Name: 1-oxido-1-tetradec-2-ynoxypyrrolidin-1-ium-2,5-dione Traditional Name: 1-oxido-1-tetradec-2-ynoxy-pyrrolidin-1-ium-2,5-quinone Formula: C18H29NO4 MolecularWeight: 323.42716

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC#CCO[N+]1(C(=O)CCC1=O)[O-]

Isomeric SMILES

CCCCCCCCCCCC#CCO[N+]1(C(=O)CCC1=O)[O-]

InChI

InChI=1S/C18H29NO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-16-23-19(22)17(20)14-15-18(19)21/h2-11,14-16H2,1H3