(5-ethanoyl-2-methoxy-phenyl)methyl 3-(2-methylpropyl)-4-oxidanylidene-phthalazine-1-carboxylate

Systemtic Name: (5-ethanoyl-2-methoxy-phenyl)methyl 3-(2-methylpropyl)-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: (5-acetyl-2-methoxy-phenyl)methyl 3-isobutyl-4-oxo-phthalazine-1-carboxylate CAS Name: 3-(2-methylpropyl)-4-oxo-1-phthalazinecarboxylic acid (5-acetyl-2-methoxyphenyl)methyl ester IUPAC Name: (5-acetyl-2-methoxyphenyl)methyl 3-(2-methylpropyl)-4-oxophthalazine-1-carboxylate Traditional Name: 3-isobutyl-4-keto-phthalazine-1-carboxylic acid (5-acetyl-2-methoxy-benzyl) ester Formula: C23H24N2O5 MolecularWeight: 408.44706

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCC3=C(C=CC(=C3)C(=O)C)OC

Isomeric SMILES

CC(C)CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCC3=C(C=CC(=C3)C(=O)C)OC

InChI

InChI=1S/C23H24N2O5/c1-14(2)12-25-22(27)19-8-6-5-7-18(19)21(24-25)23(28)30-13-17-11-16(15(3)26)9-10-20(17)29-4/h5-11,14H,12-13H2,1-4H3