3-[3-(1-benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]-1-(4-tert-butylphenyl)prop-2-en-1-one

Systemtic Name: 3-[3-(1-benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]-1-(4-tert-butylphenyl)prop-2-en-1-one Openeye Name: 3-[3-(benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]-1-(4-tert-butylphenyl)prop-2-en-1-one CAS Name: 3-[3-(2-benzofuranyl)-1-phenyl-4-pyrazolyl]-1-(4-tert-butylphenyl)-2-propen-1-one IUPAC Name: 3-[3-(1-benzofuran-2-yl)-1-phenylpyrazol-4-yl]-1-(4-tert-butylphenyl)prop-2-en-1-one Traditional Name: 3-[3-(benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]-1-(4-tert-butylphenyl)prop-2-en-1-one Formula: C30H26N2O2 MolecularWeight: 446.53964

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)C=CC2=CN(N=C2C3=CC4=CC=CC=C4O3)C5=CC=CC=C5

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)C=CC2=CN(N=C2C3=CC4=CC=CC=C4O3)C5=CC=CC=C5

InChI

InChI=1S/C30H26N2O2/c1-30(2,3)24-16-13-21(14-17-24)26(33)18-15-23-20-32(25-10-5-4-6-11-25)31-29(23)28-19-22-9-7-8-12-27(22)34-28/h4-20H,1-3H3