[(2R)-1-(4-methylphenyl)-1-oxidanylidene-propan-2-yl] 3-ethyl-4-oxidanylidene-phthalazine-1-carboxylate

Systemtic Name: [(2R)-1-(4-methylphenyl)-1-oxidanylidene-propan-2-yl] 3-ethyl-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: [(1R)-1-methyl-2-oxo-2-(p-tolyl)ethyl] 3-ethyl-4-oxo-phthalazine-1-carboxylate CAS Name: 3-ethyl-4-oxo-1-phthalazinecarboxylic acid [(2R)-1-(4-methylphenyl)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(4-methylphenyl)-1-oxopropan-2-yl] 3-ethyl-4-oxophthalazine-1-carboxylate Traditional Name: 3-ethyl-4-keto-phthalazine-1-carboxylic acid [(1R)-2-keto-1-methyl-2-(p-tolyl)ethyl] ester Formula: C21H20N2O4 MolecularWeight: 364.3945

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OC(C)C(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)O[C@H](C)C(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C21H20N2O4/c1-4-23-20(25)17-8-6-5-7-16(17)18(22-23)21(26)27-14(3)19(24)15-11-9-13(2)10-12-15/h5-12,14H,4H2,1-3H3/t14-/m1/s1