(6,6-diethoxy-5-oxidanylidene-hex-3-yn-2-yl) benzoate

Systemtic Name: (6,6-diethoxy-5-oxidanylidene-hex-3-yn-2-yl) benzoate Openeye Name: (5,5-diethoxy-1-methyl-4-oxo-pent-2-ynyl) benzoate CAS Name: benzoic acid (6,6-diethoxy-5-oxohex-3-yn-2-yl) ester IUPAC Name: (6,6-diethoxy-5-oxohex-3-yn-2-yl) benzoate Traditional Name: benzoic acid (5,5-diethoxy-4-keto-1-methyl-pent-2-ynyl) ester Formula: C17H20O5 MolecularWeight: 304.3377

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(C(=O)C#CC(C)OC(=O)C1=CC=CC=C1)OCC

Isomeric SMILES

CCOC(C(=O)C#CC(C)OC(=O)C1=CC=CC=C1)OCC

InChI

InChI=1S/C17H20O5/c1-4-20-17(21-5-2)15(18)12-11-13(3)22-16(19)14-9-7-6-8-10-14/h6-10,13,17H,4-5H2,1-3H3