(2-cyanophenyl)methyl 2-(4-aminocarbonyl-1-oxidanylidene-phthalazin-2-yl)ethanoate

Systemtic Name: (2-cyanophenyl)methyl 2-(4-aminocarbonyl-1-oxidanylidene-phthalazin-2-yl)ethanoate Openeye Name: (2-cyanophenyl)methyl 2-(4-carbamoyl-1-oxo-phthalazin-2-yl)acetate CAS Name: 2-(4-carbamoyl-1-oxo-2-phthalazinyl)acetic acid (2-cyanophenyl)methyl ester IUPAC Name: (2-cyanophenyl)methyl 2-(4-carbamoyl-1-oxophthalazin-2-yl)acetate Traditional Name: 2-(4-carbamoyl-1-keto-phthalazin-2-yl)acetic acid (2-cyanobenzyl) ester Formula: C19H14N4O4 MolecularWeight: 362.33886

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)COC(=O)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)N)C#N

Isomeric SMILES

C1=CC=C(C(=C1)COC(=O)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)N)C#N

InChI

InChI=1S/C19H14N4O4/c20-9-12-5-1-2-6-13(12)11-27-16(24)10-23-19(26)15-8-4-3-7-14(15)17(22-23)18(21)25/h1-8H,10-11H2,(H2,21,25)