[1-[(2-cyanophenyl)amino]-1-oxidanylidene-propan-2-yl] 2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanoate

Systemtic Name: [1-[(2-cyanophenyl)amino]-1-oxidanylidene-propan-2-yl] 2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanoate Openeye Name: [2-(2-cyanoanilino)-1-methyl-2-oxo-ethyl] 2-(4-oxo-3H-phthalazin-1-yl)acetate CAS Name: 2-(4-oxo-3H-phthalazin-1-yl)acetic acid [1-(2-cyanoanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2-cyanoanilino)-1-oxopropan-2-yl] 2-(4-oxo-3H-phthalazin-1-yl)acetate Traditional Name: 2-(4-keto-3H-phthalazin-1-yl)acetic acid [2-(2-cyanoanilino)-2-keto-1-methyl-ethyl] ester Formula: C20H16N4O4 MolecularWeight: 376.36544

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1C#N)OC(=O)CC2=NNC(=O)C3=CC=CC=C32

Isomeric SMILES

CC(C(=O)NC1=CC=CC=C1C#N)OC(=O)CC2=NNC(=O)C3=CC=CC=C32

InChI

InChI=1S/C20H16N4O4/c1-12(19(26)22-16-9-5-2-6-13(16)11-21)28-18(25)10-17-14-7-3-4-8-15(14)20(27)24-23-17/h2-9,12H,10H2,1H3,(H,22,26)(H,24,27)