(5-azanyl-3-carboxy-7-methyl-2-oxidanyl-4-oxidanylidene-octyl)-trimethyl-azanium

Systemtic Name: (5-azanyl-3-carboxy-7-methyl-2-oxidanyl-4-oxidanylidene-octyl)-trimethyl-azanium Openeye Name: (5-amino-3-carboxy-2-hydroxy-7-methyl-4-oxo-octyl)-trimethyl-ammonium CAS Name: (5-amino-3-carboxy-2-hydroxy-7-methyl-4-oxooctyl)-trimethylammonium IUPAC Name: (5-amino-3-carboxy-2-hydroxy-7-methyl-4-oxooctyl)-trimethylazanium Traditional Name: (5-amino-3-carboxy-2-hydroxy-4-keto-7-methyl-octyl)-trimethyl-ammonium Formula: C13H27N2O4+ MolecularWeight: 275.36448

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)C(C(C[N+](C)(C)C)O)C(=O)O)N

Isomeric SMILES

CC(C)CC(C(=O)C(C(C[N+](C)(C)C)O)C(=O)O)N

InChI

InChI=1S/C13H26N2O4/c1-8(2)6-9(14)12(17)11(13(18)19)10(16)7-15(3,4)5/h8-11,16H,6-7,14H2,1-5H3/p+1