2-(2,6-dimethylphenoxy)ethyl 4-oxidanylidene-3-propan-2-yl-phthalazine-1-carboxylate

Systemtic Name: 2-(2,6-dimethylphenoxy)ethyl 4-oxidanylidene-3-propan-2-yl-phthalazine-1-carboxylate Openeye Name: 2-(2,6-dimethylphenoxy)ethyl 3-isopropyl-4-oxo-phthalazine-1-carboxylate CAS Name: 4-oxo-3-propan-2-yl-1-phthalazinecarboxylic acid 2-(2,6-dimethylphenoxy)ethyl ester IUPAC Name: 2-(2,6-dimethylphenoxy)ethyl 4-oxo-3-propan-2-ylphthalazine-1-carboxylate Traditional Name: 3-isopropyl-4-keto-phthalazine-1-carboxylic acid 2-(2,6-dimethylphenoxy)ethyl ester Formula: C22H24N2O4 MolecularWeight: 380.43696

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OCCOC(=O)C2=NN(C(=O)C3=CC=CC=C32)C(C)C

Isomeric SMILES

CC1=C(C(=CC=C1)C)OCCOC(=O)C2=NN(C(=O)C3=CC=CC=C32)C(C)C

InChI

InChI=1S/C22H24N2O4/c1-14(2)24-21(25)18-11-6-5-10-17(18)19(23-24)22(26)28-13-12-27-20-15(3)8-7-9-16(20)4/h5-11,14H,12-13H2,1-4H3