[(2R)-1-azanyl-1-oxidanylidene-propan-2-yl] 4-oxidanylidene-3H-phthalazine-1-carboxylate

Systemtic Name: [(2R)-1-azanyl-1-oxidanylidene-propan-2-yl] 4-oxidanylidene-3H-phthalazine-1-carboxylate Openeye Name: [(1R)-2-amino-1-methyl-2-oxo-ethyl] 4-oxo-3H-phthalazine-1-carboxylate CAS Name: 4-oxo-3H-phthalazine-1-carboxylic acid [(2R)-1-amino-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-amino-1-oxopropan-2-yl] 4-oxo-3H-phthalazine-1-carboxylate Traditional Name: 4-keto-3H-phthalazine-1-carboxylic acid [(1R)-2-amino-2-keto-1-methyl-ethyl] ester Formula: C12H11N3O4 MolecularWeight: 261.23344

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N)OC(=O)C1=NNC(=O)C2=CC=CC=C21

Isomeric SMILES

C[C@H](C(=O)N)OC(=O)C1=NNC(=O)C2=CC=CC=C21

InChI

InChI=1S/C12H11N3O4/c1-6(10(13)16)19-12(18)9-7-4-2-3-5-8(7)11(17)15-14-9/h2-6H,1H3,(H2,13,16)(H,15,17)/t6-/m1/s1