1-(4-chlorophenyl)-N-[[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]methyl]methanamine

Systemtic Name: 1-(4-chlorophenyl)-N-[[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]methyl]methanamine Openeye Name: 1-(4-chlorophenyl)-N-[[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]methyl]methanamine CAS Name: 1-(4-chlorophenyl)-N-[[3-(3,4-dimethoxyphenyl)-1-phenyl-4-pyrazolyl]methyl]methanamine IUPAC Name: 1-(4-chlorophenyl)-N-[[3-(3,4-dimethoxyphenyl)-1-phenylpyrazol-4-yl]methyl]methanamine Traditional Name: (4-chlorobenzyl)-[[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]methyl]amine Formula: C25H24ClN3O2 MolecularWeight: 433.92996

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NN(C=C2CNCC3=CC=C(C=C3)Cl)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NN(C=C2CNCC3=CC=C(C=C3)Cl)C4=CC=CC=C4)OC

InChI

InChI=1S/C25H24ClN3O2/c1-30-23-13-10-19(14-24(23)31-2)25-20(16-27-15-18-8-11-21(26)12-9-18)17-29(28-25)22-6-4-3-5-7-22/h3-14,17,27H,15-16H2,1-2H3