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

Systemtic Name: [1-(methylamino)-1-oxidanylidene-propan-2-yl] 4-oxidanylidene-3H-phthalazine-1-carboxylate Openeye Name: [1-methyl-2-(methylamino)-2-oxo-ethyl] 4-oxo-3H-phthalazine-1-carboxylate CAS Name: 4-oxo-3H-phthalazine-1-carboxylic acid [1-(methylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(methylamino)-1-oxopropan-2-yl] 4-oxo-3H-phthalazine-1-carboxylate Traditional Name: 4-keto-3H-phthalazine-1-carboxylic acid [2-keto-1-methyl-2-(methylamino)ethyl] ester Formula: C13H13N3O4 MolecularWeight: 275.26002

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13N3O4/c1-7(11(17)14-2)20-13(19)10-8-5-3-4-6-9(8)12(18)16-15-10/h3-7H,1-2H3,(H,14,17)(H,16,18)