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

Systemtic Name: [(2R)-1-azanyl-1-oxidanylidene-propan-2-yl] 3-[1,3-bis(oxidanylidene)-4H-isoquinolin-2-yl]propanoate Openeye Name: [(1R)-2-amino-1-methyl-2-oxo-ethyl] 3-(1,3-dioxo-4H-isoquinolin-2-yl)propanoate CAS Name: 3-(1,3-dioxo-4H-isoquinolin-2-yl)propanoic acid [(2R)-1-amino-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-amino-1-oxopropan-2-yl] 3-(1,3-dioxo-4H-isoquinolin-2-yl)propanoate Traditional Name: 3-(1,3-diketo-4H-isoquinolin-2-yl)propionic acid [(1R)-2-amino-2-keto-1-methyl-ethyl] ester Formula: C15H16N2O5 MolecularWeight: 304.29794

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H16N2O5/c1-9(14(16)20)22-13(19)6-7-17-12(18)8-10-4-2-3-5-11(10)15(17)21/h2-5,9H,6-8H2,1H3,(H2,16,20)/t9-/m1/s1