N-[[5-(3-bromanylphenoxy)-1,3-dimethyl-pyrazol-4-yl]methyl]cyclopropanamine

Systemtic Name: N-[[5-(3-bromanylphenoxy)-1,3-dimethyl-pyrazol-4-yl]methyl]cyclopropanamine Openeye Name: N-[[5-(3-bromophenoxy)-1,3-dimethyl-pyrazol-4-yl]methyl]cyclopropanamine CAS Name: N-[[5-(3-bromophenoxy)-1,3-dimethyl-4-pyrazolyl]methyl]cyclopropanamine IUPAC Name: N-[[5-(3-bromophenoxy)-1,3-dimethylpyrazol-4-yl]methyl]cyclopropanamine Traditional Name: [5-(3-bromophenoxy)-1,3-dimethyl-pyrazol-4-yl]methyl-cyclopropyl-amine Formula: C15H18BrN3O MolecularWeight: 336.22692

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1CNC2CC2)OC3=CC(=CC=C3)Br)C

Isomeric SMILES

CC1=NN(C(=C1CNC2CC2)OC3=CC(=CC=C3)Br)C

InChI

InChI=1S/C15H18BrN3O/c1-10-14(9-17-12-6-7-12)15(19(2)18-10)20-13-5-3-4-11(16)8-13/h3-5,8,12,17H,6-7,9H2,1-2H3