diethyl 2-(1-oxidanyl-2-oxidanylidene-6-phenyl-hex-5-ynyl)propanedioate

Systemtic Name: diethyl 2-(1-oxidanyl-2-oxidanylidene-6-phenyl-hex-5-ynyl)propanedioate Openeye Name: diethyl 2-(1-hydroxy-2-oxo-6-phenyl-hex-5-ynyl)propanedioate CAS Name: 2-(1-hydroxy-2-oxo-6-phenylhex-5-ynyl)propanedioic acid diethyl ester IUPAC Name: diethyl 2-(1-hydroxy-2-oxo-6-phenylhex-5-ynyl)propanedioate Traditional Name: 2-(1-hydroxy-2-keto-6-phenyl-hex-5-ynyl)malonic acid diethyl ester Formula: C19H22O6 MolecularWeight: 346.37438

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C(=O)CCC#CC1=CC=CC=C1)O)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(C(C(=O)CCC#CC1=CC=CC=C1)O)C(=O)OCC

InChI

InChI=1S/C19H22O6/c1-3-24-18(22)16(19(23)25-4-2)17(21)15(20)13-9-8-12-14-10-6-5-7-11-14/h5-7,10-11,16-17,21H,3-4,9,13H2,1-2H3