(2,5-dimethylphenyl)methyl 2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanoate

Systemtic Name: (2,5-dimethylphenyl)methyl 2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanoate Openeye Name: (2,5-dimethylphenyl)methyl 2-(4-oxo-3H-phthalazin-1-yl)acetate CAS Name: 2-(4-oxo-3H-phthalazin-1-yl)acetic acid (2,5-dimethylphenyl)methyl ester IUPAC Name: (2,5-dimethylphenyl)methyl 2-(4-oxo-3H-phthalazin-1-yl)acetate Traditional Name: 2-(4-keto-3H-phthalazin-1-yl)acetic acid (2,5-dimethylbenzyl) ester Formula: C19H18N2O3 MolecularWeight: 322.35782

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)COC(=O)CC2=NNC(=O)C3=CC=CC=C32

Isomeric SMILES

CC1=CC(=C(C=C1)C)COC(=O)CC2=NNC(=O)C3=CC=CC=C32

InChI

InChI=1S/C19H18N2O3/c1-12-7-8-13(2)14(9-12)11-24-18(22)10-17-15-5-3-4-6-16(15)19(23)21-20-17/h3-9H,10-11H2,1-2H3,(H,21,23)