(4-propan-2-ylphenyl)methyl 3-ethyl-4-oxidanylidene-phthalazine-1-carboxylate

Systemtic Name: (4-propan-2-ylphenyl)methyl 3-ethyl-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: (4-isopropylphenyl)methyl 3-ethyl-4-oxo-phthalazine-1-carboxylate CAS Name: 3-ethyl-4-oxo-1-phthalazinecarboxylic acid (4-propan-2-ylphenyl)methyl ester IUPAC Name: (4-propan-2-ylphenyl)methyl 3-ethyl-4-oxophthalazine-1-carboxylate Traditional Name: 3-ethyl-4-keto-phthalazine-1-carboxylic acid (4-isopropylbenzyl) ester Formula: C21H22N2O3 MolecularWeight: 350.41098

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCC3=CC=C(C=C3)C(C)C

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCC3=CC=C(C=C3)C(C)C

InChI

InChI=1S/C21H22N2O3/c1-4-23-20(24)18-8-6-5-7-17(18)19(22-23)21(25)26-13-15-9-11-16(12-10-15)14(2)3/h5-12,14H,4,13H2,1-3H3