2-diethylsulfonio-1-quinolin-2-yl-propan-1-olate

Systemtic Name: 2-diethylsulfonio-1-quinolin-2-yl-propan-1-olate Openeye Name: 2-diethylsulfonio-1-(2-quinolyl)propan-1-olate CAS Name: 2-diethylsulfonio-1-(2-quinolinyl)-1-propanolate IUPAC Name: 2-diethylsulfonio-1-quinolin-2-ylpropan-1-olate Traditional Name: 2-diethylsulfonio-1-(2-quinolyl)propan-1-olate Formula: C16H21NOS MolecularWeight: 275.40904

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Descriptors Computed from Structure

Canonical SMILES:

CC[S+](CC)C(C)C(C1=NC2=CC=CC=C2C=C1)[O-]

Isomeric SMILES

CC[S+](CC)C(C)C(C1=NC2=CC=CC=C2C=C1)[O-]

InChI

InChI=1S/C16H21NOS/c1-4-19(5-2)12(3)16(18)15-11-10-13-8-6-7-9-14(13)17-15/h6-12,16H,4-5H2,1-3H3