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

Systemtic Name: (3-methyl-4-propan-2-yl-phenyl) 3-ethyl-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: (4-isopropyl-3-methyl-phenyl) 3-ethyl-4-oxo-phthalazine-1-carboxylate CAS Name: 3-ethyl-4-oxo-1-phthalazinecarboxylic acid (3-methyl-4-propan-2-ylphenyl) ester IUPAC Name: (3-methyl-4-propan-2-ylphenyl) 3-ethyl-4-oxophthalazine-1-carboxylate Traditional Name: 3-ethyl-4-keto-phthalazine-1-carboxylic acid (4-isopropyl-3-methyl-phenyl) 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)OC3=CC(=C(C=C3)C(C)C)C

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OC3=CC(=C(C=C3)C(C)C)C

InChI

InChI=1S/C21H22N2O3/c1-5-23-20(24)18-9-7-6-8-17(18)19(22-23)21(25)26-15-10-11-16(13(2)3)14(4)12-15/h6-13H,5H2,1-4H3