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

Systemtic Name: (5-ethanoyl-2-methoxy-phenyl)methyl 4-oxidanylidene-3-propyl-phthalazine-1-carboxylate Openeye Name: (5-acetyl-2-methoxy-phenyl)methyl 4-oxo-3-propyl-phthalazine-1-carboxylate CAS Name: 4-oxo-3-propyl-1-phthalazinecarboxylic acid (5-acetyl-2-methoxyphenyl)methyl ester IUPAC Name: (5-acetyl-2-methoxyphenyl)methyl 4-oxo-3-propylphthalazine-1-carboxylate Traditional Name: 4-keto-3-propyl-phthalazine-1-carboxylic acid (5-acetyl-2-methoxy-benzyl) ester Formula: C22H22N2O5 MolecularWeight: 394.42048

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCC3=C(C=CC(=C3)C(=O)C)OC

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCC3=C(C=CC(=C3)C(=O)C)OC

InChI

InChI=1S/C22H22N2O5/c1-4-11-24-21(26)18-8-6-5-7-17(18)20(23-24)22(27)29-13-16-12-15(14(2)25)9-10-19(16)28-3/h5-10,12H,4,11,13H2,1-3H3