2-(3,5-dimethylphenoxy)ethyl 4-oxidanylidene-3H-phthalazine-1-carboxylate

Systemtic Name: 2-(3,5-dimethylphenoxy)ethyl 4-oxidanylidene-3H-phthalazine-1-carboxylate Openeye Name: 2-(3,5-dimethylphenoxy)ethyl 4-oxo-3H-phthalazine-1-carboxylate CAS Name: 4-oxo-3H-phthalazine-1-carboxylic acid 2-(3,5-dimethylphenoxy)ethyl ester IUPAC Name: 2-(3,5-dimethylphenoxy)ethyl 4-oxo-3H-phthalazine-1-carboxylate Traditional Name: 4-keto-3H-phthalazine-1-carboxylic acid 2-(3,5-dimethylphenoxy)ethyl ester Formula: C19H18N2O4 MolecularWeight: 338.35722

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H18N2O4/c1-12-9-13(2)11-14(10-12)24-7-8-25-19(23)17-15-5-3-4-6-16(15)18(22)21-20-17/h3-6,9-11H,7-8H2,1-2H3,(H,21,22)