butyl 2-[[5-bromanyl-2-(2-chloranylprop-2-enoxy)phenyl]methyl]-5-(ethylamino)-1H-pyridazine-6-carboxylate

Systemtic Name: butyl 2-[[5-bromanyl-2-(2-chloranylprop-2-enoxy)phenyl]methyl]-5-(ethylamino)-1H-pyridazine-6-carboxylate Openeye Name: butyl 2-[[5-bromo-2-(2-chloroallyloxy)phenyl]methyl]-5-(ethylamino)-1H-pyridazine-6-carboxylate CAS Name: 2-[[5-bromo-2-(2-chloroprop-2-enoxy)phenyl]methyl]-5-(ethylamino)-1H-pyridazine-6-carboxylic acid butyl ester IUPAC Name: butyl 2-[[5-bromo-2-(2-chloroprop-2-enoxy)phenyl]methyl]-5-(ethylamino)-1H-pyridazine-6-carboxylate Traditional Name: 2-[5-bromo-2-(2-chloroallyloxy)benzyl]-5-(ethylamino)-1H-pyridazine-6-carboxylic acid butyl ester Formula: C21H27BrClN3O3 MolecularWeight: 484.81438

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=C(C=CN(N1)CC2=C(C=CC(=C2)Br)OCC(=C)Cl)NCC

Isomeric SMILES

CCCCOC(=O)C1=C(C=CN(N1)CC2=C(C=CC(=C2)Br)OCC(=C)Cl)NCC

InChI

InChI=1S/C21H27BrClN3O3/c1-4-6-11-28-21(27)20-18(24-5-2)9-10-26(25-20)13-16-12-17(22)7-8-19(16)29-14-15(3)23/h7-10,12,24-25H,3-6,11,13-14H2,1-2H3