(3-carboxy-3-ethanoyl-2-oxidanyl-2-propyl-hexyl)-trimethyl-azanium

Systemtic Name: (3-carboxy-3-ethanoyl-2-oxidanyl-2-propyl-hexyl)-trimethyl-azanium Openeye Name: (3-acetyl-3-carboxy-2-hydroxy-2-propyl-hexyl)-trimethyl-ammonium CAS Name: (3-acetyl-3-carboxy-2-hydroxy-2-propylhexyl)-trimethylammonium IUPAC Name: (3-acetyl-3-carboxy-2-hydroxy-2-propylhexyl)-trimethylazanium Traditional Name: (3-acetyl-3-carboxy-2-hydroxy-2-propyl-hexyl)-trimethyl-ammonium Formula: C15H30NO4+ MolecularWeight: 288.403

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C[N+](C)(C)C)(C(CCC)(C(=O)C)C(=O)O)O

Isomeric SMILES

CCCC(C[N+](C)(C)C)(C(CCC)(C(=O)C)C(=O)O)O

InChI

InChI=1S/C15H29NO4/c1-7-9-14(20,11-16(4,5)6)15(10-8-2,12(3)17)13(18)19/h20H,7-11H2,1-6H3/p+1