(2,6-dimethylphenyl) 4-oxidanylidene-3-propyl-phthalazine-1-carboxylate

Systemtic Name: (2,6-dimethylphenyl) 4-oxidanylidene-3-propyl-phthalazine-1-carboxylate Openeye Name: (2,6-dimethylphenyl) 4-oxo-3-propyl-phthalazine-1-carboxylate CAS Name: 4-oxo-3-propyl-1-phthalazinecarboxylic acid (2,6-dimethylphenyl) ester IUPAC Name: (2,6-dimethylphenyl) 4-oxo-3-propylphthalazine-1-carboxylate Traditional Name: 4-keto-3-propyl-phthalazine-1-carboxylic acid (2,6-dimethylphenyl) ester Formula: C20H20N2O3 MolecularWeight: 336.3844

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OC3=C(C=CC=C3C)C

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OC3=C(C=CC=C3C)C

InChI

InChI=1S/C20H20N2O3/c1-4-12-22-19(23)16-11-6-5-10-15(16)17(21-22)20(24)25-18-13(2)8-7-9-14(18)3/h5-11H,4,12H2,1-3H3