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

Systemtic Name: (E)-1-(5-bromanyl-1-benzofuran-2-yl)-3-(1-phenylpyrazol-4-yl)prop-2-en-1-one Openeye Name: (E)-1-(5-bromobenzofuran-2-yl)-3-(1-phenylpyrazol-4-yl)prop-2-en-1-one CAS Name: (E)-1-(5-bromo-2-benzofuranyl)-3-(1-phenyl-4-pyrazolyl)-2-propen-1-one IUPAC Name: (E)-1-(5-bromo-1-benzofuran-2-yl)-3-(1-phenylpyrazol-4-yl)prop-2-en-1-one Traditional Name: (E)-1-(5-bromobenzofuran-2-yl)-3-(1-phenylpyrazol-4-yl)prop-2-en-1-one Formula: C20H13BrN2O2 MolecularWeight: 393.23342

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C=N2)C=CC(=O)C3=CC4=C(O3)C=CC(=C4)Br

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C=N2)/C=C/C(=O)C3=CC4=C(O3)C=CC(=C4)Br

InChI

InChI=1S/C20H13BrN2O2/c21-16-7-9-19-15(10-16)11-20(25-19)18(24)8-6-14-12-22-23(13-14)17-4-2-1-3-5-17/h1-13H/b8-6+