N-[(5-bromanyl-2-propoxy-phenyl)methyl]-1H-pyrazol-4-amine

Systemtic Name: N-[(5-bromanyl-2-propoxy-phenyl)methyl]-1H-pyrazol-4-amine Openeye Name: N-[(5-bromo-2-propoxy-phenyl)methyl]-1H-pyrazol-4-amine CAS Name: N-[(5-bromo-2-propoxyphenyl)methyl]-1H-pyrazol-4-amine IUPAC Name: N-[(5-bromo-2-propoxyphenyl)methyl]-1H-pyrazol-4-amine Traditional Name: (5-bromo-2-propoxy-benzyl)-(1H-pyrazol-4-yl)amine Formula: C13H16BrN3O MolecularWeight: 310.18964

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)Br)CNC2=CNN=C2

Isomeric SMILES

CCCOC1=C(C=C(C=C1)Br)CNC2=CNN=C2

InChI

InChI=1S/C13H16BrN3O/c1-2-5-18-13-4-3-11(14)6-10(13)7-15-12-8-16-17-9-12/h3-4,6,8-9,15H,2,5,7H2,1H3,(H,16,17)