methyl 2-cyano-2-(3-piperidin-1-ylquinoxalin-2-yl)ethanoate

Systemtic Name: methyl 2-cyano-2-(3-piperidin-1-ylquinoxalin-2-yl)ethanoate Openeye Name: methyl 2-cyano-2-[3-(1-piperidyl)quinoxalin-2-yl]acetate CAS Name: 2-cyano-2-[3-(1-piperidinyl)-2-quinoxalinyl]acetic acid methyl ester IUPAC Name: methyl 2-cyano-2-(3-piperidin-1-ylquinoxalin-2-yl)acetate Traditional Name: 2-cyano-2-(3-piperidinoquinoxalin-2-yl)acetic acid methyl ester Formula: C17H18N4O2 MolecularWeight: 310.35042

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C#N)C1=NC2=CC=CC=C2N=C1N3CCCCC3

Isomeric SMILES

COC(=O)C(C#N)C1=NC2=CC=CC=C2N=C1N3CCCCC3

InChI

InChI=1S/C17H18N4O2/c1-23-17(22)12(11-18)15-16(21-9-5-2-6-10-21)20-14-8-4-3-7-13(14)19-15/h3-4,7-8,12H,2,5-6,9-10H2,1H3