tert-butyl 2-(4-oxidanylidene-5,6,7,8-tetrahydro-3H-phthalazin-1-yl)ethanoate

Systemtic Name: tert-butyl 2-(4-oxidanylidene-5,6,7,8-tetrahydro-3H-phthalazin-1-yl)ethanoate Openeye Name: tert-butyl 2-(4-oxo-5,6,7,8-tetrahydro-3H-phthalazin-1-yl)acetate CAS Name: 2-(4-oxo-5,6,7,8-tetrahydro-3H-phthalazin-1-yl)acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-(4-oxo-5,6,7,8-tetrahydro-3H-phthalazin-1-yl)acetate Traditional Name: 2-(4-keto-5,6,7,8-tetrahydro-3H-phthalazin-1-yl)acetic acid tert-butyl ester Formula: C14H20N2O3 MolecularWeight: 264.3202

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CC1=NNC(=O)C2=C1CCCC2

Isomeric SMILES

CC(C)(C)OC(=O)CC1=NNC(=O)C2=C1CCCC2

InChI

InChI=1S/C14H20N2O3/c1-14(2,3)19-12(17)8-11-9-6-4-5-7-10(9)13(18)16-15-11/h4-8H2,1-3H3,(H,16,18)