ethyl 2-[3-[bis(2-methylpropyl)amino]quinoxalin-2-yl]-2-cyano-ethanoate

Systemtic Name: ethyl 2-[3-[bis(2-methylpropyl)amino]quinoxalin-2-yl]-2-cyano-ethanoate Openeye Name: ethyl 2-cyano-2-[3-(diisobutylamino)quinoxalin-2-yl]acetate CAS Name: 2-[3-[bis(2-methylpropyl)amino]-2-quinoxalinyl]-2-cyanoacetic acid ethyl ester IUPAC Name: ethyl 2-[3-[bis(2-methylpropyl)amino]quinoxalin-2-yl]-2-cyanoacetate Traditional Name: 2-cyano-2-[3-(diisobutylamino)quinoxalin-2-yl]acetic acid ethyl ester Formula: C21H28N4O2 MolecularWeight: 368.47262

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C#N)C1=NC2=CC=CC=C2N=C1N(CC(C)C)CC(C)C

Isomeric SMILES

CCOC(=O)C(C#N)C1=NC2=CC=CC=C2N=C1N(CC(C)C)CC(C)C

InChI

InChI=1S/C21H28N4O2/c1-6-27-21(26)16(11-22)19-20(25(12-14(2)3)13-15(4)5)24-18-10-8-7-9-17(18)23-19/h7-10,14-16H,6,12-13H2,1-5H3