[(1R)-1-cyanoethyl] 2-[1,3-bis(oxidanylidene)-4H-isoquinolin-2-yl]ethanoate

Systemtic Name: [(1R)-1-cyanoethyl] 2-[1,3-bis(oxidanylidene)-4H-isoquinolin-2-yl]ethanoate Openeye Name: [(1R)-1-cyanoethyl] 2-(1,3-dioxo-4H-isoquinolin-2-yl)acetate CAS Name: 2-(1,3-dioxo-4H-isoquinolin-2-yl)acetic acid [(1R)-1-cyanoethyl] ester IUPAC Name: [(1R)-1-cyanoethyl] 2-(1,3-dioxo-4H-isoquinolin-2-yl)acetate Traditional Name: 2-(1,3-diketo-4H-isoquinolin-2-yl)acetic acid [(1R)-1-cyanoethyl] ester Formula: C14H12N2O4 MolecularWeight: 272.25608

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)OC(=O)CN1C(=O)CC2=CC=CC=C2C1=O

Isomeric SMILES

C[C@H](C#N)OC(=O)CN1C(=O)CC2=CC=CC=C2C1=O

InChI

InChI=1S/C14H12N2O4/c1-9(7-15)20-13(18)8-16-12(17)6-10-4-2-3-5-11(10)14(16)19/h2-5,9H,6,8H2,1H3/t9-/m1/s1