prop-2-enyl (2R)-2-cyano-2-(3-pyrrolidin-1-ylquinoxalin-2-yl)ethanoate

Systemtic Name: prop-2-enyl (2R)-2-cyano-2-(3-pyrrolidin-1-ylquinoxalin-2-yl)ethanoate Openeye Name: allyl (2R)-2-cyano-2-(3-pyrrolidin-1-ylquinoxalin-2-yl)acetate CAS Name: (2R)-2-cyano-2-[3-(1-pyrrolidinyl)-2-quinoxalinyl]acetic acid prop-2-enyl ester IUPAC Name: prop-2-enyl (2R)-2-cyano-2-(3-pyrrolidin-1-ylquinoxalin-2-yl)acetate Traditional Name: (2R)-2-cyano-2-(3-pyrrolidinoquinoxalin-2-yl)acetic acid allyl ester Formula: C18H18N4O2 MolecularWeight: 322.36112

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCOC(=O)C(C#N)C1=NC2=CC=CC=C2N=C1N3CCCC3

Isomeric SMILES

C=CCOC(=O)[C@@H](C#N)C1=NC2=CC=CC=C2N=C1N3CCCC3

InChI

InChI=1S/C18H18N4O2/c1-2-11-24-18(23)13(12-19)16-17(22-9-5-6-10-22)21-15-8-4-3-7-14(15)20-16/h2-4,7-8,13H,1,5-6,9-11H2/t13-/m0/s1