ethyl 1-[2-oxidanylidene-2-[(4-oxidanylidene-3H-phthalazin-1-yl)methylamino]ethanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-oxidanylidene-2-[(4-oxidanylidene-3H-phthalazin-1-yl)methylamino]ethanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-oxo-2-[(4-oxo-3H-phthalazin-1-yl)methylamino]acetyl]piperidine-4-carboxylate CAS Name: 1-[1,2-dioxo-2-[(4-oxo-3H-phthalazin-1-yl)methylamino]ethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-oxo-2-[(4-oxo-3H-phthalazin-1-yl)methylamino]acetyl]piperidine-4-carboxylate Traditional Name: 1-[2-keto-2-[(4-keto-3H-phthalazin-1-yl)methylamino]acetyl]isonipecotic acid ethyl ester Formula: C19H22N4O5 MolecularWeight: 386.40178

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C(=O)NCC2=NNC(=O)C3=CC=CC=C32

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C(=O)NCC2=NNC(=O)C3=CC=CC=C32

InChI

InChI=1S/C19H22N4O5/c1-2-28-19(27)12-7-9-23(10-8-12)18(26)17(25)20-11-15-13-5-3-4-6-14(13)16(24)22-21-15/h3-6,12H,2,7-11H2,1H3,(H,20,25)(H,22,24)