1-[2-[2,2-dimethyl-4-(1-oxidanidylpyridin-1-ium-4-yl)butanoyl]pyrrolidin-1-yl]pentane-1,2-dione

Systemtic Name: 1-[2-[2,2-dimethyl-4-(1-oxidanidylpyridin-1-ium-4-yl)butanoyl]pyrrolidin-1-yl]pentane-1,2-dione Openeye Name: 1-[2-[2,2-dimethyl-4-(1-oxidopyridin-1-ium-4-yl)butanoyl]pyrrolidin-1-yl]pentane-1,2-dione CAS Name: 1-[2-[2,2-dimethyl-4-(1-oxido-4-pyridin-1-iumyl)-1-oxobutyl]-1-pyrrolidinyl]pentane-1,2-dione IUPAC Name: 1-[2-[2,2-dimethyl-4-(1-oxidopyridin-1-ium-4-yl)butanoyl]pyrrolidin-1-yl]pentane-1,2-dione Traditional Name: 1-[2-[2,2-dimethyl-4-(1-oxidopyridin-1-ium-4-yl)butanoyl]pyrrolidino]pentane-1,2-dione Formula: C20H28N2O4 MolecularWeight: 360.44732

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C(=O)N1CCCC1C(=O)C(C)(C)CCC2=CC=[N+](C=C2)[O-]

Isomeric SMILES

CCCC(=O)C(=O)N1CCCC1C(=O)C(C)(C)CCC2=CC=[N+](C=C2)[O-]

InChI

InChI=1S/C20H28N2O4/c1-4-6-17(23)19(25)22-12-5-7-16(22)18(24)20(2,3)11-8-15-9-13-21(26)14-10-15/h9-10,13-14,16H,4-8,11-12H2,1-3H3