[1-(aminocarbonylamino)-1-oxidanylidene-propan-2-yl] 3-methyl-4-oxidanylidene-phthalazine-1-carboxylate

Systemtic Name: [1-(aminocarbonylamino)-1-oxidanylidene-propan-2-yl] 3-methyl-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: (1-methyl-2-oxo-2-ureido-ethyl) 3-methyl-4-oxo-phthalazine-1-carboxylate CAS Name: 3-methyl-4-oxo-1-phthalazinecarboxylic acid [1-(carbamoylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(carbamoylamino)-1-oxopropan-2-yl] 3-methyl-4-oxophthalazine-1-carboxylate Traditional Name: 4-keto-3-methyl-phthalazine-1-carboxylic acid (2-keto-1-methyl-2-ureido-ethyl) ester Formula: C14H14N4O5 MolecularWeight: 318.28476

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)N)OC(=O)C1=NN(C(=O)C2=CC=CC=C21)C

Isomeric SMILES

CC(C(=O)NC(=O)N)OC(=O)C1=NN(C(=O)C2=CC=CC=C21)C

InChI

InChI=1S/C14H14N4O5/c1-7(11(19)16-14(15)22)23-13(21)10-8-5-3-4-6-9(8)12(20)18(2)17-10/h3-7H,1-2H3,(H3,15,16,19,22)