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

Systemtic Name: N-[[5-(4-chloranylphenoxy)-1,3-dimethyl-pyrazol-4-yl]methyl]cyclopropanamine Openeye Name: N-[[5-(4-chlorophenoxy)-1,3-dimethyl-pyrazol-4-yl]methyl]cyclopropanamine CAS Name: N-[[5-(4-chlorophenoxy)-1,3-dimethyl-4-pyrazolyl]methyl]cyclopropanamine IUPAC Name: N-[[5-(4-chlorophenoxy)-1,3-dimethylpyrazol-4-yl]methyl]cyclopropanamine Traditional Name: [5-(4-chlorophenoxy)-1,3-dimethyl-pyrazol-4-yl]methyl-cyclopropyl-amine Formula: C15H18ClN3O MolecularWeight: 291.77592

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H18ClN3O/c1-10-14(9-17-12-5-6-12)15(19(2)18-10)20-13-7-3-11(16)4-8-13/h3-4,7-8,12,17H,5-6,9H2,1-2H3