methyl 2-cyano-2-[3-(dibutylamino)quinoxalin-2-yl]ethanoate

Systemtic Name: methyl 2-cyano-2-[3-(dibutylamino)quinoxalin-2-yl]ethanoate Openeye Name: methyl 2-cyano-2-[3-(dibutylamino)quinoxalin-2-yl]acetate CAS Name: 2-cyano-2-[3-(dibutylamino)-2-quinoxalinyl]acetic acid methyl ester IUPAC Name: methyl 2-cyano-2-[3-(dibutylamino)quinoxalin-2-yl]acetate Traditional Name: 2-cyano-2-[3-(dibutylamino)quinoxalin-2-yl]acetic acid methyl ester Formula: C20H26N4O2 MolecularWeight: 354.44604

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H26N4O2/c1-4-6-12-24(13-7-5-2)19-18(15(14-21)20(25)26-3)22-16-10-8-9-11-17(16)23-19/h8-11,15H,4-7,12-13H2,1-3H3