methyl 2-[3-[butyl(ethyl)amino]quinoxalin-2-yl]-2-cyano-ethanoate

Systemtic Name: methyl 2-[3-[butyl(ethyl)amino]quinoxalin-2-yl]-2-cyano-ethanoate Openeye Name: methyl 2-[3-[butyl(ethyl)amino]quinoxalin-2-yl]-2-cyano-acetate CAS Name: 2-[3-[butyl(ethyl)amino]-2-quinoxalinyl]-2-cyanoacetic acid methyl ester IUPAC Name: methyl 2-[3-[butyl(ethyl)amino]quinoxalin-2-yl]-2-cyanoacetate Traditional Name: 2-[3-[butyl(ethyl)amino]quinoxalin-2-yl]-2-cyano-acetic acid methyl ester Formula: C18H22N4O2 MolecularWeight: 326.39288

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC)C1=NC2=CC=CC=C2N=C1C(C#N)C(=O)OC

Isomeric SMILES

CCCCN(CC)C1=NC2=CC=CC=C2N=C1C(C#N)C(=O)OC

InChI

InChI=1S/C18H22N4O2/c1-4-6-11-22(5-2)17-16(13(12-19)18(23)24-3)20-14-9-7-8-10-15(14)21-17/h7-10,13H,4-6,11H2,1-3H3