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

Systemtic Name: butyl 2-[(5-bromanyl-2-oxidanyl-phenyl)methyl]-5-(ethylamino)-1H-pyridazine-6-carboxylate Openeye Name: butyl 2-[(5-bromo-2-hydroxy-phenyl)methyl]-5-(ethylamino)-1H-pyridazine-6-carboxylate CAS Name: 2-[(5-bromo-2-hydroxyphenyl)methyl]-5-(ethylamino)-1H-pyridazine-6-carboxylic acid butyl ester IUPAC Name: butyl 2-[(5-bromo-2-hydroxyphenyl)methyl]-5-(ethylamino)-1H-pyridazine-6-carboxylate Traditional Name: 2-(5-bromo-2-hydroxy-benzyl)-5-(ethylamino)-1H-pyridazine-6-carboxylic acid butyl ester Formula: C18H24BrN3O3 MolecularWeight: 410.30546

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H24BrN3O3/c1-3-5-10-25-18(24)17-15(20-4-2)8-9-22(21-17)12-13-11-14(19)6-7-16(13)23/h6-9,11,20-21,23H,3-5,10,12H2,1-2H3