propan-2-yl 2-cyano-2-[3-(3,4-dihydro-1H-isoquinolin-2-yl)quinoxalin-2-yl]ethanoate

Systemtic Name: propan-2-yl 2-cyano-2-[3-(3,4-dihydro-1H-isoquinolin-2-yl)quinoxalin-2-yl]ethanoate Openeye Name: isopropyl 2-cyano-2-[3-(3,4-dihydro-1H-isoquinolin-2-yl)quinoxalin-2-yl]acetate CAS Name: 2-cyano-2-[3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-quinoxalinyl]acetic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-cyano-2-[3-(3,4-dihydro-1H-isoquinolin-2-yl)quinoxalin-2-yl]acetate Traditional Name: 2-cyano-2-[3-(3,4-dihydro-1H-isoquinolin-2-yl)quinoxalin-2-yl]acetic acid isopropyl ester Formula: C23H22N4O2 MolecularWeight: 386.44638

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C(C#N)C1=NC2=CC=CC=C2N=C1N3CCC4=CC=CC=C4C3

Isomeric SMILES

CC(C)OC(=O)C(C#N)C1=NC2=CC=CC=C2N=C1N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C23H22N4O2/c1-15(2)29-23(28)18(13-24)21-22(26-20-10-6-5-9-19(20)25-21)27-12-11-16-7-3-4-8-17(16)14-27/h3-10,15,18H,11-12,14H2,1-2H3