(E)-3-[3-(4-bromophenyl)-1-phenyl-pyrazol-4-yl]-1-(2,4-dimethoxyphenyl)prop-2-en-1-one

Systemtic Name: (E)-3-[3-(4-bromophenyl)-1-phenyl-pyrazol-4-yl]-1-(2,4-dimethoxyphenyl)prop-2-en-1-one Openeye Name: (E)-3-[3-(4-bromophenyl)-1-phenyl-pyrazol-4-yl]-1-(2,4-dimethoxyphenyl)prop-2-en-1-one CAS Name: (E)-3-[3-(4-bromophenyl)-1-phenyl-4-pyrazolyl]-1-(2,4-dimethoxyphenyl)-2-propen-1-one IUPAC Name: (E)-3-[3-(4-bromophenyl)-1-phenylpyrazol-4-yl]-1-(2,4-dimethoxyphenyl)prop-2-en-1-one Traditional Name: (E)-3-[3-(4-bromophenyl)-1-phenyl-pyrazol-4-yl]-1-(2,4-dimethoxyphenyl)prop-2-en-1-one Formula: C26H21BrN2O3 MolecularWeight: 489.36054

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C(=O)C=CC2=CN(N=C2C3=CC=C(C=C3)Br)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=CC(=C(C=C1)C(=O)/C=C/C2=CN(N=C2C3=CC=C(C=C3)Br)C4=CC=CC=C4)OC

InChI

InChI=1S/C26H21BrN2O3/c1-31-22-13-14-23(25(16-22)32-2)24(30)15-10-19-17-29(21-6-4-3-5-7-21)28-26(19)18-8-11-20(27)12-9-18/h3-17H,1-2H3/b15-10+