4-[3-[3-(1-benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]prop-2-enoyl]benzenecarbonitrile

Systemtic Name: 4-[3-[3-(1-benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]prop-2-enoyl]benzenecarbonitrile Openeye Name: 4-[3-[3-(benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]prop-2-enoyl]benzonitrile CAS Name: 4-[3-[3-(2-benzofuranyl)-1-phenyl-4-pyrazolyl]-1-oxoprop-2-enyl]benzonitrile IUPAC Name: 4-[3-[3-(1-benzofuran-2-yl)-1-phenylpyrazol-4-yl]prop-2-enoyl]benzonitrile Traditional Name: 4-[3-[3-(benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]acryloyl]benzonitrile Formula: C27H17N3O2 MolecularWeight: 415.44278

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC4=CC=CC=C4O3)C=CC(=O)C5=CC=C(C=C5)C#N

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC4=CC=CC=C4O3)C=CC(=O)C5=CC=C(C=C5)C#N

InChI

InChI=1S/C27H17N3O2/c28-17-19-10-12-20(13-11-19)24(31)15-14-22-18-30(23-7-2-1-3-8-23)29-27(22)26-16-21-6-4-5-9-25(21)32-26/h1-16,18H