3-[3-(4-fluorophenyl)-6-oxidanylidene-5-(phenylmethyl)pyridazin-1-yl]propanoate

Systemtic Name: 3-[3-(4-fluorophenyl)-6-oxidanylidene-5-(phenylmethyl)pyridazin-1-yl]propanoate Openeye Name: 3-[5-benzyl-3-(4-fluorophenyl)-6-oxo-pyridazin-1-yl]propanoate CAS Name: 3-[3-(4-fluorophenyl)-6-oxo-5-(phenylmethyl)-1-pyridazinyl]propanoate IUPAC Name: 3-[5-benzyl-3-(4-fluorophenyl)-6-oxopyridazin-1-yl]propanoate Traditional Name: 3-[5-benzyl-3-(4-fluorophenyl)-6-keto-pyridazin-1-yl]propionate Formula: C20H16FN2O3- MolecularWeight: 351.351043

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CC(=NN(C2=O)CCC(=O)[O-])C3=CC=C(C=C3)F

Isomeric SMILES

C1=CC=C(C=C1)CC2=CC(=NN(C2=O)CCC(=O)[O-])C3=CC=C(C=C3)F

InChI

InChI=1S/C20H17FN2O3/c21-17-8-6-15(7-9-17)18-13-16(12-14-4-2-1-3-5-14)20(26)23(22-18)11-10-19(24)25/h1-9,13H,10-12H2,(H,24,25)/p-1