3-[(3-fluorophenyl)methyl]-4-oxidanylidene-phthalazine-1-carboxylate

Systemtic Name: 3-[(3-fluorophenyl)methyl]-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: 3-[(3-fluorophenyl)methyl]-4-oxo-phthalazine-1-carboxylate CAS Name: 3-[(3-fluorophenyl)methyl]-4-oxo-1-phthalazinecarboxylate IUPAC Name: 3-[(3-fluorophenyl)methyl]-4-oxophthalazine-1-carboxylate Traditional Name: 3-(3-fluorobenzyl)-4-keto-phthalazine-1-carboxylate Formula: C16H10FN2O3- MolecularWeight: 297.260603

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NN(C2=O)CC3=CC(=CC=C3)F)C(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=NN(C2=O)CC3=CC(=CC=C3)F)C(=O)[O-]

InChI

InChI=1S/C16H11FN2O3/c17-11-5-3-4-10(8-11)9-19-15(20)13-7-2-1-6-12(13)14(18-19)16(21)22/h1-8H,9H2,(H,21,22)/p-1