(4-tert-butyl-2-methyl-phenyl) 2-(3-methyl-4-oxidanylidene-phthalazin-1-yl)ethanoate

Systemtic Name: (4-tert-butyl-2-methyl-phenyl) 2-(3-methyl-4-oxidanylidene-phthalazin-1-yl)ethanoate Openeye Name: (4-tert-butyl-2-methyl-phenyl) 2-(3-methyl-4-oxo-phthalazin-1-yl)acetate CAS Name: 2-(3-methyl-4-oxo-1-phthalazinyl)acetic acid (4-tert-butyl-2-methylphenyl) ester IUPAC Name: (4-tert-butyl-2-methylphenyl) 2-(3-methyl-4-oxophthalazin-1-yl)acetate Traditional Name: 2-(4-keto-3-methyl-phthalazin-1-yl)acetic acid (4-tert-butyl-2-methyl-phenyl) ester Formula: C22H24N2O3 MolecularWeight: 364.43756

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(C)(C)C)OC(=O)CC2=NN(C(=O)C3=CC=CC=C32)C

Isomeric SMILES

CC1=C(C=CC(=C1)C(C)(C)C)OC(=O)CC2=NN(C(=O)C3=CC=CC=C32)C

InChI

InChI=1S/C22H24N2O3/c1-14-12-15(22(2,3)4)10-11-19(14)27-20(25)13-18-16-8-6-7-9-17(16)21(26)24(5)23-18/h6-12H,13H2,1-5H3