5-bromanyl-4-[(3-butoxy-4-methoxy-phenyl)methylamino]-1H-pyridazin-6-one

Systemtic Name: 5-bromanyl-4-[(3-butoxy-4-methoxy-phenyl)methylamino]-1H-pyridazin-6-one Openeye Name: 5-bromo-4-[(3-butoxy-4-methoxy-phenyl)methylamino]-1H-pyridazin-6-one CAS Name: 5-bromo-4-[(3-butoxy-4-methoxyphenyl)methylamino]-1H-pyridazin-6-one IUPAC Name: 5-bromo-4-[(3-butoxy-4-methoxyphenyl)methylamino]-1H-pyridazin-6-one Traditional Name: 5-bromo-4-[(3-butoxy-4-methoxy-benzyl)amino]-1H-pyridazin-6-one Formula: C16H20BrN3O3 MolecularWeight: 382.2523

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=CC(=C1)CNC2=C(C(=O)NN=C2)Br)OC

Isomeric SMILES

CCCCOC1=C(C=CC(=C1)CNC2=C(C(=O)NN=C2)Br)OC

InChI

InChI=1S/C16H20BrN3O3/c1-3-4-7-23-14-8-11(5-6-13(14)22-2)9-18-12-10-19-20-16(21)15(12)17/h5-6,8,10H,3-4,7,9H2,1-2H3,(H2,18,20,21)