(2S,4E)-4-[[3-(1-benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]methylidene]-2-methyl-2,3-dihydro-1H-acridine-9-carboxylate

Systemtic Name: (2S,4E)-4-[[3-(1-benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]methylidene]-2-methyl-2,3-dihydro-1H-acridine-9-carboxylate Openeye Name: (2S,4E)-4-[[3-(benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]methylene]-2-methyl-2,3-dihydro-1H-acridine-9-carboxylate CAS Name: (2S,4E)-4-[[3-(2-benzofuranyl)-1-phenyl-4-pyrazolyl]methylidene]-2-methyl-2,3-dihydro-1H-acridine-9-carboxylate IUPAC Name: (2S,4E)-4-[[3-(1-benzofuran-2-yl)-1-phenylpyrazol-4-yl]methylidene]-2-methyl-2,3-dihydro-1H-acridine-9-carboxylate Traditional Name: (2S,4E)-4-[[3-(benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]methylene]-2-methyl-2,3-dihydro-1H-acridine-9-carboxylate Formula: C33H24N3O3- MolecularWeight: 510.56196

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=CC2=CN(N=C2C3=CC4=CC=CC=C4O3)C5=CC=CC=C5)C6=NC7=CC=CC=C7C(=C6C1)C(=O)[O-]

Isomeric SMILES

C[C@H]1C/C(=C\C2=CN(N=C2C3=CC4=CC=CC=C4O3)C5=CC=CC=C5)/C6=NC7=CC=CC=C7C(=C6C1)C(=O)[O-]

InChI

InChI=1S/C33H25N3O3/c1-20-15-22(31-26(16-20)30(33(37)38)25-12-6-7-13-27(25)34-31)17-23-19-36(24-10-3-2-4-11-24)35-32(23)29-18-21-9-5-8-14-28(21)39-29/h2-14,17-20H,15-16H2,1H3,(H,37,38)/p-1/b22-17+/t20-/m0/s1