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

Systemtic Name: (5-ethanoyl-2-methoxy-phenyl)methyl 3-hexyl-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: (5-acetyl-2-methoxy-phenyl)methyl 3-hexyl-4-oxo-phthalazine-1-carboxylate CAS Name: 3-hexyl-4-oxo-1-phthalazinecarboxylic acid (5-acetyl-2-methoxyphenyl)methyl ester IUPAC Name: (5-acetyl-2-methoxyphenyl)methyl 3-hexyl-4-oxophthalazine-1-carboxylate Traditional Name: 3-hexyl-4-keto-phthalazine-1-carboxylic acid (5-acetyl-2-methoxy-benzyl) ester Formula: C25H28N2O5 MolecularWeight: 436.50022

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCC3=C(C=CC(=C3)C(=O)C)OC

Isomeric SMILES

CCCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCC3=C(C=CC(=C3)C(=O)C)OC

InChI

InChI=1S/C25H28N2O5/c1-4-5-6-9-14-27-24(29)21-11-8-7-10-20(21)23(26-27)25(30)32-16-19-15-18(17(2)28)12-13-22(19)31-3/h7-8,10-13,15H,4-6,9,14,16H2,1-3H3