3-[2-[(4-fluorophenyl)methylamino]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxylate

Systemtic Name: 3-[2-[(4-fluorophenyl)methylamino]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: 3-[2-[(4-fluorophenyl)methylamino]-2-oxo-ethyl]-4-oxo-phthalazine-1-carboxylate CAS Name: 3-[2-[(4-fluorophenyl)methylamino]-2-oxoethyl]-4-oxo-1-phthalazinecarboxylate IUPAC Name: 3-[2-[(4-fluorophenyl)methylamino]-2-oxoethyl]-4-oxophthalazine-1-carboxylate Traditional Name: 3-[2-[(4-fluorobenzyl)amino]-2-keto-ethyl]-4-keto-phthalazine-1-carboxylate Formula: C18H13FN3O4- MolecularWeight: 354.311923

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NN(C2=O)CC(=O)NCC3=CC=C(C=C3)F)C(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=NN(C2=O)CC(=O)NCC3=CC=C(C=C3)F)C(=O)[O-]

InChI

InChI=1S/C18H14FN3O4/c19-12-7-5-11(6-8-12)9-20-15(23)10-22-17(24)14-4-2-1-3-13(14)16(21-22)18(25)26/h1-8H,9-10H2,(H,20,23)(H,25,26)/p-1