ethyl 3-(4-fluorophenyl)-3-[1-[(4-oxidanylidene-3H-phthalazin-1-yl)carbonyl]piperidin-4-yl]propanoate

Systemtic Name: ethyl 3-(4-fluorophenyl)-3-[1-[(4-oxidanylidene-3H-phthalazin-1-yl)carbonyl]piperidin-4-yl]propanoate Openeye Name: ethyl 3-(4-fluorophenyl)-3-[1-(4-oxo-3H-phthalazine-1-carbonyl)-4-piperidyl]propanoate CAS Name: 3-(4-fluorophenyl)-3-[1-[oxo-(4-oxo-3H-phthalazin-1-yl)methyl]-4-piperidinyl]propanoic acid ethyl ester IUPAC Name: ethyl 3-(4-fluorophenyl)-3-[1-(4-oxo-3H-phthalazine-1-carbonyl)piperidin-4-yl]propanoate Traditional Name: 3-(4-fluorophenyl)-3-[1-(4-keto-3H-phthalazine-1-carbonyl)-4-piperidyl]propionic acid ethyl ester Formula: C25H26FN3O4 MolecularWeight: 451.490043

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C1CCN(CC1)C(=O)C2=NNC(=O)C3=CC=CC=C32)C4=CC=C(C=C4)F

Isomeric SMILES

CCOC(=O)CC(C1CCN(CC1)C(=O)C2=NNC(=O)C3=CC=CC=C32)C4=CC=C(C=C4)F

InChI

InChI=1S/C25H26FN3O4/c1-2-33-22(30)15-21(16-7-9-18(26)10-8-16)17-11-13-29(14-12-17)25(32)23-19-5-3-4-6-20(19)24(31)28-27-23/h3-10,17,21H,2,11-15H2,1H3,(H,28,31)