5-chloranyl-3-ethoxy-4-[[4-methoxy-3-(2-methylpropoxy)phenyl]methylamino]-1H-pyridazin-6-one

Systemtic Name: 5-chloranyl-3-ethoxy-4-[[4-methoxy-3-(2-methylpropoxy)phenyl]methylamino]-1H-pyridazin-6-one Openeye Name: 5-chloro-3-ethoxy-4-[(3-isobutoxy-4-methoxy-phenyl)methylamino]-1H-pyridazin-6-one CAS Name: 5-chloro-3-ethoxy-4-[[4-methoxy-3-(2-methylpropoxy)phenyl]methylamino]-1H-pyridazin-6-one IUPAC Name: 5-chloro-3-ethoxy-4-[[4-methoxy-3-(2-methylpropoxy)phenyl]methylamino]-1H-pyridazin-6-one Traditional Name: 5-chloro-3-ethoxy-4-[(3-isobutoxy-4-methoxy-benzyl)amino]-1H-pyridazin-6-one Formula: C18H24ClN3O4 MolecularWeight: 381.85386

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NNC(=O)C(=C1NCC2=CC(=C(C=C2)OC)OCC(C)C)Cl

Isomeric SMILES

CCOC1=NNC(=O)C(=C1NCC2=CC(=C(C=C2)OC)OCC(C)C)Cl

InChI

InChI=1S/C18H24ClN3O4/c1-5-25-18-16(15(19)17(23)21-22-18)20-9-12-6-7-13(24-4)14(8-12)26-10-11(2)3/h6-8,11H,5,9-10H2,1-4H3,(H2,20,21,23)