ethyl 1-(3-bromophenyl)-4-[2-[(4-fluorophenyl)methylamino]-2-oxidanylidene-ethoxy]-6-oxidanylidene-pyridazine-3-carboxylate

Systemtic Name: ethyl 1-(3-bromophenyl)-4-[2-[(4-fluorophenyl)methylamino]-2-oxidanylidene-ethoxy]-6-oxidanylidene-pyridazine-3-carboxylate Openeye Name: ethyl 1-(3-bromophenyl)-4-[2-[(4-fluorophenyl)methylamino]-2-oxo-ethoxy]-6-oxo-pyridazine-3-carboxylate CAS Name: 1-(3-bromophenyl)-4-[2-[(4-fluorophenyl)methylamino]-2-oxoethoxy]-6-oxo-3-pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(3-bromophenyl)-4-[2-[(4-fluorophenyl)methylamino]-2-oxoethoxy]-6-oxopyridazine-3-carboxylate Traditional Name: 1-(3-bromophenyl)-4-[2-[(4-fluorobenzyl)amino]-2-keto-ethoxy]-6-keto-pyridazine-3-carboxylic acid ethyl ester Formula: C22H19BrFN3O5 MolecularWeight: 504.305763

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=O)C=C1OCC(=O)NCC2=CC=C(C=C2)F)C3=CC(=CC=C3)Br

Isomeric SMILES

CCOC(=O)C1=NN(C(=O)C=C1OCC(=O)NCC2=CC=C(C=C2)F)C3=CC(=CC=C3)Br

InChI

InChI=1S/C22H19BrFN3O5/c1-2-31-22(30)21-18(11-20(29)27(26-21)17-5-3-4-15(23)10-17)32-13-19(28)25-12-14-6-8-16(24)9-7-14/h3-11H,2,12-13H2,1H3,(H,25,28)