[(4S)-4-acetyloxy-4-phenyl-but-2-ynyl]-diethyl-azanium

Systemtic Name: [(4S)-4-acetyloxy-4-phenyl-but-2-ynyl]-diethyl-azanium Openeye Name: [(4S)-4-acetoxy-4-phenyl-but-2-ynyl]-diethyl-ammonium CAS Name: [(4S)-4-acetyloxy-4-phenylbut-2-ynyl]-diethylammonium IUPAC Name: [(4S)-4-acetyloxy-4-phenylbut-2-ynyl]-diethylazanium Traditional Name: [(4S)-4-acetoxy-4-phenyl-but-2-ynyl]-diethyl-ammonium Formula: C16H22NO2+ MolecularWeight: 260.35138

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC#CC(C1=CC=CC=C1)OC(=O)C

Isomeric SMILES

CC[NH+](CC)CC#C[C@H](C1=CC=CC=C1)OC(=O)C

InChI

InChI=1S/C16H21NO2/c1-4-17(5-2)13-9-12-16(19-14(3)18)15-10-7-6-8-11-15/h6-8,10-11,16H,4-5,13H2,1-3H3/p+1/t16-/m1/s1