N-[[3,5-bis(bromanyl)-4-methoxy-phenyl]methyl]-1-pyrazol-1-yl-propan-2-amine

Systemtic Name: N-[[3,5-bis(bromanyl)-4-methoxy-phenyl]methyl]-1-pyrazol-1-yl-propan-2-amine Openeye Name: N-[(3,5-dibromo-4-methoxy-phenyl)methyl]-1-pyrazol-1-yl-propan-2-amine CAS Name: N-[(3,5-dibromo-4-methoxyphenyl)methyl]-1-(1-pyrazolyl)-2-propanamine IUPAC Name: N-[(3,5-dibromo-4-methoxyphenyl)methyl]-1-pyrazol-1-ylpropan-2-amine Traditional Name: (3,5-dibromo-4-methoxy-benzyl)-(1-methyl-2-pyrazol-1-yl-ethyl)amine Formula: C14H17Br2N3O MolecularWeight: 403.11228

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C=CC=N1)NCC2=CC(=C(C(=C2)Br)OC)Br

Isomeric SMILES

CC(CN1C=CC=N1)NCC2=CC(=C(C(=C2)Br)OC)Br

InChI

InChI=1S/C14H17Br2N3O/c1-10(9-19-5-3-4-18-19)17-8-11-6-12(15)14(20-2)13(16)7-11/h3-7,10,17H,8-9H2,1-2H3