diethyl 2-[(E)-4-acetyloxy-6-phenyl-hex-2-en-5-ynyl]-2-prop-2-ynyl-propanedioate

Systemtic Name: diethyl 2-[(E)-4-acetyloxy-6-phenyl-hex-2-en-5-ynyl]-2-prop-2-ynyl-propanedioate Openeye Name: diethyl 2-[(E)-4-acetoxy-6-phenyl-hex-2-en-5-ynyl]-2-prop-2-ynyl-propanedioate CAS Name: 2-[(E)-4-acetyloxy-6-phenylhex-2-en-5-ynyl]-2-prop-2-ynylpropanedioic acid diethyl ester IUPAC Name: diethyl 2-[(E)-4-acetyloxy-6-phenylhex-2-en-5-ynyl]-2-prop-2-ynylpropanedioate Traditional Name: 2-[(E)-4-acetoxy-6-phenyl-hex-2-en-5-ynyl]-2-propargyl-malonic acid diethyl ester Formula: C24H26O6 MolecularWeight: 410.45964

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCOC(=O)C(C/C=C/C(C#CC1=CC=CC=C1)OC(=O)C)(CC#C)C(=O)OCC

InChI

InChI=1S/C24H26O6/c1-5-17-24(22(26)28-6-2,23(27)29-7-3)18-11-14-21(30-19(4)25)16-15-20-12-9-8-10-13-20/h1,8-14,21H,6-7,17-18H2,2-4H3/b14-11+