ethyl 2-[3-[(4-cyanophenyl)methyl]-4-oxidanylidene-phthalazin-1-yl]ethanoate

Systemtic Name: ethyl 2-[3-[(4-cyanophenyl)methyl]-4-oxidanylidene-phthalazin-1-yl]ethanoate Openeye Name: ethyl 2-[3-[(4-cyanophenyl)methyl]-4-oxo-phthalazin-1-yl]acetate CAS Name: 2-[3-[(4-cyanophenyl)methyl]-4-oxo-1-phthalazinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[3-[(4-cyanophenyl)methyl]-4-oxophthalazin-1-yl]acetate Traditional Name: 2-[3-(4-cyanobenzyl)-4-keto-phthalazin-1-yl]acetic acid ethyl ester Formula: C20H17N3O3 MolecularWeight: 347.36728

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=NN(C(=O)C2=CC=CC=C21)CC3=CC=C(C=C3)C#N

Isomeric SMILES

CCOC(=O)CC1=NN(C(=O)C2=CC=CC=C21)CC3=CC=C(C=C3)C#N

InChI

InChI=1S/C20H17N3O3/c1-2-26-19(24)11-18-16-5-3-4-6-17(16)20(25)23(22-18)13-15-9-7-14(12-21)8-10-15/h3-10H,2,11,13H2,1H3