[1-(4-fluorophenyl)carbonyl-2-oxidanylidene-azepan-3-yl] 2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanoate

Systemtic Name: [1-(4-fluorophenyl)carbonyl-2-oxidanylidene-azepan-3-yl] 2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanoate Openeye Name: [1-(4-fluorobenzoyl)-2-oxo-azepan-3-yl] 2-(4-oxo-3H-phthalazin-1-yl)acetate CAS Name: 2-(4-oxo-3H-phthalazin-1-yl)acetic acid [1-[(4-fluorophenyl)-oxomethyl]-2-oxo-3-azepanyl] ester IUPAC Name: [1-(4-fluorobenzoyl)-2-oxoazepan-3-yl] 2-(4-oxo-3H-phthalazin-1-yl)acetate Traditional Name: 2-(4-keto-3H-phthalazin-1-yl)acetic acid [1-(4-fluorobenzoyl)-2-keto-azepan-3-yl] ester Formula: C23H20FN3O5 MolecularWeight: 437.420403

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(=O)C(C1)OC(=O)CC2=NNC(=O)C3=CC=CC=C32)C(=O)C4=CC=C(C=C4)F

Isomeric SMILES

C1CCN(C(=O)C(C1)OC(=O)CC2=NNC(=O)C3=CC=CC=C32)C(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H20FN3O5/c24-15-10-8-14(9-11-15)22(30)27-12-4-3-7-19(23(27)31)32-20(28)13-18-16-5-1-2-6-17(16)21(29)26-25-18/h1-2,5-6,8-11,19H,3-4,7,12-13H2,(H,26,29)