(E)-1-(1-benzofuran-2-yl)-3-[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]prop-2-en-1-one

Systemtic Name: (E)-1-(1-benzofuran-2-yl)-3-[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]prop-2-en-1-one Openeye Name: (E)-1-(benzofuran-2-yl)-3-(1-benzyl-3,5-dimethyl-pyrazol-4-yl)prop-2-en-1-one CAS Name: (E)-1-(2-benzofuranyl)-3-[3,5-dimethyl-1-(phenylmethyl)-4-pyrazolyl]-2-propen-1-one IUPAC Name: (E)-1-(1-benzofuran-2-yl)-3-(1-benzyl-3,5-dimethylpyrazol-4-yl)prop-2-en-1-one Traditional Name: (E)-1-(benzofuran-2-yl)-3-(1-benzyl-3,5-dimethyl-pyrazol-4-yl)prop-2-en-1-one Formula: C23H20N2O2 MolecularWeight: 356.4171

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=CC=C2)C)C=CC(=O)C3=CC4=CC=CC=C4O3

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=CC=C2)C)/C=C/C(=O)C3=CC4=CC=CC=C4O3

InChI

InChI=1S/C23H20N2O2/c1-16-20(17(2)25(24-16)15-18-8-4-3-5-9-18)12-13-21(26)23-14-19-10-6-7-11-22(19)27-23/h3-14H,15H2,1-2H3/b13-12+