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hexyl (2R)-2-cyano-2-(3-piperidin-1-ylquinoxalin-2-yl)ethanoate

hexyl (2R)-2-cyano-2-(3-piperidin-1-ylquinoxalin-2-yl)ethanoate

Systemtic Name:hexyl (2R)-2-cyano-2-(3-piperidin-1-ylquinoxalin-2-yl)ethanoate
Openeye Name:hexyl (2R)-2-cyano-2-[3-(1-piperidyl)quinoxalin-2-yl]acetate
CAS Name:(2R)-2-cyano-2-[3-(1-piperidinyl)-2-quinoxalinyl]acetic acid hexyl ester
IUPAC Name:hexyl (2R)-2-cyano-2-(3-piperidin-1-ylquinoxalin-2-yl)acetate
Traditional Name:(2R)-2-cyano-2-(3-piperidinoquinoxalin-2-yl)acetic acid hexyl ester
Formula: C22H28N4O2
MolecularWeight: 380.48332
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

CCCCCCOC(=O)[C@@H](C#N)C1=NC2=CC=CC=C2N=C1N3CCCCC3


InChI

InChI=1S/C22H28N4O2/c1-2-3-4-10-15-28-22(27)17(16-23)20-21(26-13-8-5-9-14-26)25-19-12-7-6-11-18(19)24-20/h6-7,11-12,17H,2-5,8-10,13-15H2,1H3/t17-/m0/s1


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