(4-methoxy-2-methyl-4-oxidanylidene-3-phenylsulfanyl-butan-2-yl)azanium

Systemtic Name: (4-methoxy-2-methyl-4-oxidanylidene-3-phenylsulfanyl-butan-2-yl)azanium Openeye Name: (3-methoxy-1,1-dimethyl-3-oxo-2-phenylsulfanyl-propyl)ammonium CAS Name: [4-methoxy-2-methyl-4-oxo-3-(phenylthio)butan-2-yl]ammonium IUPAC Name: (4-methoxy-2-methyl-4-oxo-3-phenylsulfanylbutan-2-yl)azanium Traditional Name: [3-keto-3-methoxy-1,1-dimethyl-2-(phenylthio)propyl]ammonium Formula: C12H18NO2S+ MolecularWeight: 240.34182

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(C(=O)OC)SC1=CC=CC=C1)[NH3+]

Isomeric SMILES

CC(C)(C(C(=O)OC)SC1=CC=CC=C1)[NH3+]

InChI

InChI=1S/C12H17NO2S/c1-12(2,13)10(11(14)15-3)16-9-7-5-4-6-8-9/h4-8,10H,13H2,1-3H3/p+1