[3-carboxy-6-methyl-6-oxidanyl-4,8-bis(oxidanylidene)oxocan-2-yl]methyl-trimethyl-azanium

Systemtic Name: [3-carboxy-6-methyl-6-oxidanyl-4,8-bis(oxidanylidene)oxocan-2-yl]methyl-trimethyl-azanium Openeye Name: (3-carboxy-6-hydroxy-6-methyl-4,8-dioxo-oxocan-2-yl)methyl-trimethyl-ammonium CAS Name: (3-carboxy-6-hydroxy-6-methyl-4,8-dioxo-2-oxocanyl)methyl-trimethylammonium IUPAC Name: (3-carboxy-6-hydroxy-6-methyl-4,8-dioxooxocan-2-yl)methyl-trimethylazanium Traditional Name: (3-carboxy-6-hydroxy-4,8-diketo-6-methyl-oxocan-2-yl)methyl-trimethyl-ammonium Formula: C13H22NO6+ MolecularWeight: 288.31688

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C(C(OC(=O)C1)C[N+](C)(C)C)C(=O)O)O

Isomeric SMILES

CC1(CC(=O)C(C(OC(=O)C1)C[N+](C)(C)C)C(=O)O)O

InChI

InChI=1S/C13H21NO6/c1-13(19)5-8(15)11(12(17)18)9(7-14(2,3)4)20-10(16)6-13/h9,11,19H,5-7H2,1-4H3/p+1