(2-methylphenyl)methyl 4-oxidanylidene-3-propyl-phthalazine-1-carboxylate

Systemtic Name: (2-methylphenyl)methyl 4-oxidanylidene-3-propyl-phthalazine-1-carboxylate Openeye Name: o-tolylmethyl 4-oxo-3-propyl-phthalazine-1-carboxylate CAS Name: 4-oxo-3-propyl-1-phthalazinecarboxylic acid (2-methylphenyl)methyl ester IUPAC Name: (2-methylphenyl)methyl 4-oxo-3-propylphthalazine-1-carboxylate Traditional Name: 4-keto-3-propyl-phthalazine-1-carboxylic acid (2-methylbenzyl) 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)OCC3=CC=CC=C3C

Isomeric SMILES

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

InChI

InChI=1S/C20H20N2O3/c1-3-12-22-19(23)17-11-7-6-10-16(17)18(21-22)20(24)25-13-15-9-5-4-8-14(15)2/h4-11H,3,12-13H2,1-2H3