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

Systemtic Name: 5-bromanyl-4-[(4-methoxy-3-pentoxy-phenyl)methylamino]-1H-pyridazin-6-one Openeye Name: 5-bromo-4-[(4-methoxy-3-pentoxy-phenyl)methylamino]-1H-pyridazin-6-one CAS Name: 5-bromo-4-[(4-methoxy-3-pentoxyphenyl)methylamino]-1H-pyridazin-6-one IUPAC Name: 5-bromo-4-[(4-methoxy-3-pentoxyphenyl)methylamino]-1H-pyridazin-6-one Traditional Name: 4-[(3-amoxy-4-methoxy-benzyl)amino]-5-bromo-1H-pyridazin-6-one Formula: C17H22BrN3O3 MolecularWeight: 396.27888

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=CC(=C1)CNC2=C(C(=O)NN=C2)Br)OC

Isomeric SMILES

CCCCCOC1=C(C=CC(=C1)CNC2=C(C(=O)NN=C2)Br)OC

InChI

InChI=1S/C17H22BrN3O3/c1-3-4-5-8-24-15-9-12(6-7-14(15)23-2)10-19-13-11-20-21-17(22)16(13)18/h6-7,9,11H,3-5,8,10H2,1-2H3,(H2,19,21,22)