trimethyl-[(1S)-5-oxidanylidene-1-sulfanyl-hex-2-ynyl]azanium

Systemtic Name: trimethyl-[(1S)-5-oxidanylidene-1-sulfanyl-hex-2-ynyl]azanium Openeye Name: trimethyl-[(1S)-5-oxo-1-sulfanyl-hex-2-ynyl]ammonium CAS Name: [(1S)-1-mercapto-5-oxohex-2-ynyl]-trimethylammonium IUPAC Name: trimethyl-[(1S)-5-oxo-1-sulfanylhex-2-ynyl]azanium Traditional Name: [(1S)-5-keto-1-mercapto-hex-2-ynyl]-trimethyl-ammonium Formula: C9H16NOS+ MolecularWeight: 186.29444

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC#CC([N+](C)(C)C)S

Isomeric SMILES

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

InChI

InChI=1S/C9H15NOS/c1-8(11)6-5-7-9(12)10(2,3)4/h9H,6H2,1-4H3/p+1/t9-/m0/s1