diethyl 2-[2,3-bis(3-ethoxybut-1-ynyl)quinoxalin-6-yl]carbonylpropanedioate

Systemtic Name: diethyl 2-[2,3-bis(3-ethoxybut-1-ynyl)quinoxalin-6-yl]carbonylpropanedioate Openeye Name: diethyl 2-[2,3-bis(3-ethoxybut-1-ynyl)quinoxaline-6-carbonyl]propanedioate CAS Name: 2-[[2,3-bis(3-ethoxybut-1-ynyl)-6-quinoxalinyl]-oxomethyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[2,3-bis(3-ethoxybut-1-ynyl)quinoxaline-6-carbonyl]propanedioate Traditional Name: 2-[2,3-bis(3-ethoxybut-1-ynyl)quinoxaline-6-carbonyl]malonic acid diethyl ester Formula: C28H32N2O7 MolecularWeight: 508.56288

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(C)C#CC1=C(N=C2C=C(C=CC2=N1)C(=O)C(C(=O)OCC)C(=O)OCC)C#CC(C)OCC

Isomeric SMILES

CCOC(C)C#CC1=C(N=C2C=C(C=CC2=N1)C(=O)C(C(=O)OCC)C(=O)OCC)C#CC(C)OCC

InChI

InChI=1S/C28H32N2O7/c1-7-34-18(5)11-14-21-22(15-12-19(6)35-8-2)30-24-17-20(13-16-23(24)29-21)26(31)25(27(32)36-9-3)28(33)37-10-4/h13,16-19,25H,7-10H2,1-6H3