(4-propan-2-ylphenyl)methyl 2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanoate

Systemtic Name: (4-propan-2-ylphenyl)methyl 2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanoate Openeye Name: (4-isopropylphenyl)methyl 2-(4-oxo-3H-phthalazin-1-yl)acetate CAS Name: 2-(4-oxo-3H-phthalazin-1-yl)acetic acid (4-propan-2-ylphenyl)methyl ester IUPAC Name: (4-propan-2-ylphenyl)methyl 2-(4-oxo-3H-phthalazin-1-yl)acetate Traditional Name: 2-(4-keto-3H-phthalazin-1-yl)acetic acid (4-isopropylbenzyl) ester Formula: C20H20N2O3 MolecularWeight: 336.3844

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)COC(=O)CC2=NNC(=O)C3=CC=CC=C32

Isomeric SMILES

CC(C)C1=CC=C(C=C1)COC(=O)CC2=NNC(=O)C3=CC=CC=C32

InChI

InChI=1S/C20H20N2O3/c1-13(2)15-9-7-14(8-10-15)12-25-19(23)11-18-16-5-3-4-6-17(16)20(24)22-21-18/h3-10,13H,11-12H2,1-2H3,(H,22,24)