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

Systemtic Name: [(1R)-1-cyanoethyl] 3-[1,3-bis(oxidanylidene)-4H-isoquinolin-2-yl]propanoate Openeye Name: [(1R)-1-cyanoethyl] 3-(1,3-dioxo-4H-isoquinolin-2-yl)propanoate CAS Name: 3-(1,3-dioxo-4H-isoquinolin-2-yl)propanoic acid [(1R)-1-cyanoethyl] ester IUPAC Name: [(1R)-1-cyanoethyl] 3-(1,3-dioxo-4H-isoquinolin-2-yl)propanoate Traditional Name: 3-(1,3-diketo-4H-isoquinolin-2-yl)propionic acid [(1R)-1-cyanoethyl] ester Formula: C15H14N2O4 MolecularWeight: 286.28266

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)OC(=O)CCN1C(=O)CC2=CC=CC=C2C1=O

Isomeric SMILES

C[C@H](C#N)OC(=O)CCN1C(=O)CC2=CC=CC=C2C1=O

InChI

InChI=1S/C15H14N2O4/c1-10(9-16)21-14(19)6-7-17-13(18)8-11-4-2-3-5-12(11)15(17)20/h2-5,10H,6-8H2,1H3/t10-/m1/s1