trimethyl-[2-(2-methyl-2-phenoxy-propanoyl)oxy-4-oxidanyl-4-oxidanylidene-butyl]azanium

Systemtic Name: trimethyl-[2-(2-methyl-2-phenoxy-propanoyl)oxy-4-oxidanyl-4-oxidanylidene-butyl]azanium Openeye Name: [4-hydroxy-2-(2-methyl-2-phenoxy-propanoyl)oxy-4-oxo-butyl]-trimethyl-ammonium CAS Name: [4-hydroxy-2-(2-methyl-1-oxo-2-phenoxypropoxy)-4-oxobutyl]-trimethylammonium IUPAC Name: [4-hydroxy-2-(2-methyl-2-phenoxypropanoyl)oxy-4-oxobutyl]-trimethylazanium Traditional Name: [4-hydroxy-4-keto-2-(2-methyl-2-phenoxy-propanoyl)oxy-butyl]-trimethyl-ammonium Formula: C17H26NO5+ MolecularWeight: 324.39204

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)OC(CC(=O)O)C[N+](C)(C)C)OC1=CC=CC=C1

Isomeric SMILES

CC(C)(C(=O)OC(CC(=O)O)C[N+](C)(C)C)OC1=CC=CC=C1

InChI

InChI=1S/C17H25NO5/c1-17(2,23-13-9-7-6-8-10-13)16(21)22-14(11-15(19)20)12-18(3,4)5/h6-10,14H,11-12H2,1-5H3/p+1