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

Systemtic Name: [(2S)-1-(ethylamino)-1-oxidanylidene-propan-2-yl] 4-oxidanylidene-3H-phthalazine-1-carboxylate Openeye Name: [(1S)-2-(ethylamino)-1-methyl-2-oxo-ethyl] 4-oxo-3H-phthalazine-1-carboxylate CAS Name: 4-oxo-3H-phthalazine-1-carboxylic acid [(2S)-1-(ethylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(ethylamino)-1-oxopropan-2-yl] 4-oxo-3H-phthalazine-1-carboxylate Traditional Name: 4-keto-3H-phthalazine-1-carboxylic acid [(1S)-2-(ethylamino)-2-keto-1-methyl-ethyl] ester Formula: C14H15N3O4 MolecularWeight: 289.2866

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H15N3O4/c1-3-15-12(18)8(2)21-14(20)11-9-6-4-5-7-10(9)13(19)17-16-11/h4-8H,3H2,1-2H3,(H,15,18)(H,17,19)/t8-/m0/s1