3-butan-2-yloxy-4-[(3-butoxy-4-methoxy-phenyl)methylamino]-5-chloranyl-1H-pyridazin-6-one

Systemtic Name: 3-butan-2-yloxy-4-[(3-butoxy-4-methoxy-phenyl)methylamino]-5-chloranyl-1H-pyridazin-6-one Openeye Name: 4-[(3-butoxy-4-methoxy-phenyl)methylamino]-5-chloro-3-sec-butoxy-1H-pyridazin-6-one CAS Name: 3-butan-2-yloxy-4-[(3-butoxy-4-methoxyphenyl)methylamino]-5-chloro-1H-pyridazin-6-one IUPAC Name: 3-butan-2-yloxy-4-[(3-butoxy-4-methoxyphenyl)methylamino]-5-chloro-1H-pyridazin-6-one Traditional Name: 4-[(3-butoxy-4-methoxy-benzyl)amino]-5-chloro-3-sec-butoxy-1H-pyridazin-6-one Formula: C20H28ClN3O4 MolecularWeight: 409.90702

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=CC(=C1)CNC2=C(C(=O)NN=C2OC(C)CC)Cl)OC

Isomeric SMILES

CCCCOC1=C(C=CC(=C1)CNC2=C(C(=O)NN=C2OC(C)CC)Cl)OC

InChI

InChI=1S/C20H28ClN3O4/c1-5-7-10-27-16-11-14(8-9-15(16)26-4)12-22-18-17(21)19(25)23-24-20(18)28-13(3)6-2/h8-9,11,13H,5-7,10,12H2,1-4H3,(H2,22,23,25)