(E)-1-(2,3-dihydro-1-benzofuran-5-yl)-3-(1-phenylpyrazol-4-yl)prop-2-en-1-one

Systemtic Name: (E)-1-(2,3-dihydro-1-benzofuran-5-yl)-3-(1-phenylpyrazol-4-yl)prop-2-en-1-one Openeye Name: (E)-1-(2,3-dihydrobenzofuran-5-yl)-3-(1-phenylpyrazol-4-yl)prop-2-en-1-one CAS Name: (E)-1-(2,3-dihydrobenzofuran-5-yl)-3-(1-phenyl-4-pyrazolyl)-2-propen-1-one IUPAC Name: (E)-1-(2,3-dihydro-1-benzofuran-5-yl)-3-(1-phenylpyrazol-4-yl)prop-2-en-1-one Traditional Name: (E)-1-coumaran-5-yl-3-(1-phenylpyrazol-4-yl)prop-2-en-1-one Formula: C20H16N2O2 MolecularWeight: 316.35324

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C1C=C(C=C2)C(=O)C=CC3=CN(N=C3)C4=CC=CC=C4

Isomeric SMILES

C1COC2=C1C=C(C=C2)C(=O)/C=C/C3=CN(N=C3)C4=CC=CC=C4

InChI

InChI=1S/C20H16N2O2/c23-19(16-7-9-20-17(12-16)10-11-24-20)8-6-15-13-21-22(14-15)18-4-2-1-3-5-18/h1-9,12-14H,10-11H2/b8-6+