ethyl (2S)-2-cyano-2-(3-morpholin-4-ylquinoxalin-2-yl)ethanoate

Systemtic Name: ethyl (2S)-2-cyano-2-(3-morpholin-4-ylquinoxalin-2-yl)ethanoate Openeye Name: ethyl (2S)-2-cyano-2-(3-morpholinoquinoxalin-2-yl)acetate CAS Name: (2S)-2-cyano-2-[3-(4-morpholinyl)-2-quinoxalinyl]acetic acid ethyl ester IUPAC Name: ethyl (2S)-2-cyano-2-(3-morpholin-4-ylquinoxalin-2-yl)acetate Traditional Name: (2S)-2-cyano-2-(3-morpholinoquinoxalin-2-yl)acetic acid ethyl ester Formula: C17H18N4O3 MolecularWeight: 326.34982

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C#N)C1=NC2=CC=CC=C2N=C1N3CCOCC3

Isomeric SMILES

CCOC(=O)[C@H](C#N)C1=NC2=CC=CC=C2N=C1N3CCOCC3

InChI

InChI=1S/C17H18N4O3/c1-2-24-17(22)12(11-18)15-16(21-7-9-23-10-8-21)20-14-6-4-3-5-13(14)19-15/h3-6,12H,2,7-10H2,1H3/t12-/m1/s1