propyl (2S)-2-(3-chloranylquinoxalin-2-yl)-2-cyano-ethanoate

Systemtic Name: propyl (2S)-2-(3-chloranylquinoxalin-2-yl)-2-cyano-ethanoate Openeye Name: propyl (2S)-2-(3-chloroquinoxalin-2-yl)-2-cyano-acetate CAS Name: (2S)-2-(3-chloro-2-quinoxalinyl)-2-cyanoacetic acid propyl ester IUPAC Name: propyl (2S)-2-(3-chloroquinoxalin-2-yl)-2-cyanoacetate Traditional Name: (2S)-2-(3-chloroquinoxalin-2-yl)-2-cyano-acetic acid propyl ester Formula: C14H12ClN3O2 MolecularWeight: 289.71698

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C(C#N)C1=NC2=CC=CC=C2N=C1Cl

Isomeric SMILES

CCCOC(=O)[C@H](C#N)C1=NC2=CC=CC=C2N=C1Cl

InChI

InChI=1S/C14H12ClN3O2/c1-2-7-20-14(19)9(8-16)12-13(15)18-11-6-4-3-5-10(11)17-12/h3-6,9H,2,7H2,1H3/t9-/m1/s1