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

Systemtic Name: N-[[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]methyl]-1-phenyl-methanamine hydrochloride Openeye Name: N-[[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]methyl]-1-phenyl-methanamine hydrochloride CAS Name: N-[[3-(3,4-dimethoxyphenyl)-1-phenyl-4-pyrazolyl]methyl]-1-phenylmethanamine hydrochloride IUPAC Name: N-[[3-(3,4-dimethoxyphenyl)-1-phenylpyrazol-4-yl]methyl]-1-phenylmethanamine hydrochloride Traditional Name: benzyl-[[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]methyl]amine hydrochloride Formula: C25H26ClN3O2 MolecularWeight: 435.94584

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H25N3O2.ClH/c1-29-23-14-13-20(15-24(23)30-2)25-21(17-26-16-19-9-5-3-6-10-19)18-28(27-25)22-11-7-4-8-12-22;/h3-15,18,26H,16-17H2,1-2H3;1H