trimethyl-[4-(2-methylpropoxy)-4-oxidanylidene-2-[(2R)-2-sulfanylpropanoyl]oxy-butyl]azanium

Systemtic Name: trimethyl-[4-(2-methylpropoxy)-4-oxidanylidene-2-[(2R)-2-sulfanylpropanoyl]oxy-butyl]azanium Openeye Name: [4-isobutoxy-4-oxo-2-[(2R)-2-sulfanylpropanoyl]oxy-butyl]-trimethyl-ammonium CAS Name: [2-[(2R)-2-mercapto-1-oxopropoxy]-4-(2-methylpropoxy)-4-oxobutyl]-trimethylammonium IUPAC Name: trimethyl-[4-(2-methylpropoxy)-4-oxo-2-[(2R)-2-sulfanylpropanoyl]oxybutyl]azanium Traditional Name: [4-isobutoxy-4-keto-2-[(2R)-2-mercaptopropanoyl]oxy-butyl]-trimethyl-ammonium Formula: C14H28NO4S+ MolecularWeight: 306.44142

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)CC(C[N+](C)(C)C)OC(=O)C(C)S

Isomeric SMILES

C[C@H](C(=O)OC(CC(=O)OCC(C)C)C[N+](C)(C)C)S

InChI

InChI=1S/C14H27NO4S/c1-10(2)9-18-13(16)7-12(8-15(4,5)6)19-14(17)11(3)20/h10-12H,7-9H2,1-6H3/p+1/t11-,12?/m1/s1