[2-(2-methylbutan-2-ylamino)-2-oxidanylidene-ethyl] 2-(3-methyl-4-oxidanylidene-phthalazin-1-yl)ethanoate

Systemtic Name: [2-(2-methylbutan-2-ylamino)-2-oxidanylidene-ethyl] 2-(3-methyl-4-oxidanylidene-phthalazin-1-yl)ethanoate Openeye Name: [2-(1,1-dimethylpropylamino)-2-oxo-ethyl] 2-(3-methyl-4-oxo-phthalazin-1-yl)acetate CAS Name: 2-(3-methyl-4-oxo-1-phthalazinyl)acetic acid [2-(2-methylbutan-2-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(2-methylbutan-2-ylamino)-2-oxoethyl] 2-(3-methyl-4-oxophthalazin-1-yl)acetate Traditional Name: 2-(4-keto-3-methyl-phthalazin-1-yl)acetic acid [2-(tert-amylamino)-2-keto-ethyl] ester Formula: C18H23N3O4 MolecularWeight: 345.39292

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)NC(=O)COC(=O)CC1=NN(C(=O)C2=CC=CC=C21)C

Isomeric SMILES

CCC(C)(C)NC(=O)COC(=O)CC1=NN(C(=O)C2=CC=CC=C21)C

InChI

InChI=1S/C18H23N3O4/c1-5-18(2,3)19-15(22)11-25-16(23)10-14-12-8-6-7-9-13(12)17(24)21(4)20-14/h6-9H,5,10-11H2,1-4H3,(H,19,22)