5-bromanyl-4-[(3-ethoxy-4-methoxy-phenyl)methylamino]-3-propan-2-yloxy-1H-pyridazin-6-one

Systemtic Name: 5-bromanyl-4-[(3-ethoxy-4-methoxy-phenyl)methylamino]-3-propan-2-yloxy-1H-pyridazin-6-one Openeye Name: 5-bromo-4-[(3-ethoxy-4-methoxy-phenyl)methylamino]-3-isopropoxy-1H-pyridazin-6-one CAS Name: 5-bromo-4-[(3-ethoxy-4-methoxyphenyl)methylamino]-3-propan-2-yloxy-1H-pyridazin-6-one IUPAC Name: 5-bromo-4-[(3-ethoxy-4-methoxyphenyl)methylamino]-3-propan-2-yloxy-1H-pyridazin-6-one Traditional Name: 5-bromo-4-[(3-ethoxy-4-methoxy-benzyl)amino]-3-isopropoxy-1H-pyridazin-6-one Formula: C17H22BrN3O4 MolecularWeight: 412.27828

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)CNC2=C(C(=O)NN=C2OC(C)C)Br)OC

Isomeric SMILES

CCOC1=C(C=CC(=C1)CNC2=C(C(=O)NN=C2OC(C)C)Br)OC

InChI

InChI=1S/C17H22BrN3O4/c1-5-24-13-8-11(6-7-12(13)23-4)9-19-15-14(18)16(22)20-21-17(15)25-10(2)3/h6-8,10H,5,9H2,1-4H3,(H2,19,20,22)