N-[(3-bromanyl-4-ethoxy-5-methoxy-phenyl)methyl]-1H-pyrazol-4-amine

Systemtic Name: N-[(3-bromanyl-4-ethoxy-5-methoxy-phenyl)methyl]-1H-pyrazol-4-amine Openeye Name: N-[(3-bromo-4-ethoxy-5-methoxy-phenyl)methyl]-1H-pyrazol-4-amine CAS Name: N-[(3-bromo-4-ethoxy-5-methoxyphenyl)methyl]-1H-pyrazol-4-amine IUPAC Name: N-[(3-bromo-4-ethoxy-5-methoxyphenyl)methyl]-1H-pyrazol-4-amine Traditional Name: (3-bromo-4-ethoxy-5-methoxy-benzyl)-(1H-pyrazol-4-yl)amine Formula: C13H16BrN3O2 MolecularWeight: 326.18904

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Br)CNC2=CNN=C2)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1Br)CNC2=CNN=C2)OC

InChI

InChI=1S/C13H16BrN3O2/c1-3-19-13-11(14)4-9(5-12(13)18-2)6-15-10-7-16-17-8-10/h4-5,7-8,15H,3,6H2,1-2H3,(H,16,17)