(3-ethanoyl-2,4,6-trimethyl-phenyl)methyl 4-oxidanylidene-3-propyl-phthalazine-1-carboxylate

Systemtic Name: (3-ethanoyl-2,4,6-trimethyl-phenyl)methyl 4-oxidanylidene-3-propyl-phthalazine-1-carboxylate Openeye Name: (3-acetyl-2,4,6-trimethyl-phenyl)methyl 4-oxo-3-propyl-phthalazine-1-carboxylate CAS Name: 4-oxo-3-propyl-1-phthalazinecarboxylic acid (3-acetyl-2,4,6-trimethylphenyl)methyl ester IUPAC Name: (3-acetyl-2,4,6-trimethylphenyl)methyl 4-oxo-3-propylphthalazine-1-carboxylate Traditional Name: 4-keto-3-propyl-phthalazine-1-carboxylic acid (3-acetyl-2,4,6-trimethyl-benzyl) ester Formula: C24H26N2O4 MolecularWeight: 406.47424

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCC3=C(C=C(C(=C3C)C(=O)C)C)C

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCC3=C(C=C(C(=C3C)C(=O)C)C)C

InChI

InChI=1S/C24H26N2O4/c1-6-11-26-23(28)19-10-8-7-9-18(19)22(25-26)24(29)30-13-20-14(2)12-15(3)21(16(20)4)17(5)27/h7-10,12H,6,11,13H2,1-5H3