(5-bromanyl-3-carboxy-2-oxidanyl-4-oxidanylidene-nonadecyl)-trimethyl-azanium

Systemtic Name: (5-bromanyl-3-carboxy-2-oxidanyl-4-oxidanylidene-nonadecyl)-trimethyl-azanium Openeye Name: (5-bromo-3-carboxy-2-hydroxy-4-oxo-nonadecyl)-trimethyl-ammonium CAS Name: (5-bromo-3-carboxy-2-hydroxy-4-oxononadecyl)-trimethylammonium IUPAC Name: (5-bromo-3-carboxy-2-hydroxy-4-oxononadecyl)-trimethylazanium Traditional Name: (5-bromo-3-carboxy-2-hydroxy-4-keto-nonadecyl)-trimethyl-ammonium Formula: C23H45BrNO4+ MolecularWeight: 479.5117

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC(C(=O)C(C(C[N+](C)(C)C)O)C(=O)O)Br

Isomeric SMILES

CCCCCCCCCCCCCCC(C(=O)C(C(C[N+](C)(C)C)O)C(=O)O)Br

InChI

InChI=1S/C23H44BrNO4/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-19(24)22(27)21(23(28)29)20(26)18-25(2,3)4/h19-21,26H,5-18H2,1-4H3/p+1