2-methylbutyl 2-cyano-2-[3-(4-methylpiperidin-1-yl)quinoxalin-2-yl]ethanoate

Systemtic Name: 2-methylbutyl 2-cyano-2-[3-(4-methylpiperidin-1-yl)quinoxalin-2-yl]ethanoate Openeye Name: 2-methylbutyl 2-cyano-2-[3-(4-methyl-1-piperidyl)quinoxalin-2-yl]acetate CAS Name: 2-cyano-2-[3-(4-methyl-1-piperidinyl)-2-quinoxalinyl]acetic acid 2-methylbutyl ester IUPAC Name: 2-methylbutyl 2-cyano-2-[3-(4-methylpiperidin-1-yl)quinoxalin-2-yl]acetate Traditional Name: 2-cyano-2-[3-(4-methylpiperidino)quinoxalin-2-yl]acetic acid 2-methylbutyl ester Formula: C22H28N4O2 MolecularWeight: 380.48332

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)COC(=O)C(C#N)C1=NC2=CC=CC=C2N=C1N3CCC(CC3)C

Isomeric SMILES

CCC(C)COC(=O)C(C#N)C1=NC2=CC=CC=C2N=C1N3CCC(CC3)C

InChI

InChI=1S/C22H28N4O2/c1-4-15(2)14-28-22(27)17(13-23)20-21(26-11-9-16(3)10-12-26)25-19-8-6-5-7-18(19)24-20/h5-8,15-17H,4,9-12,14H2,1-3H3