[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]-(2-pyridin-4-ylquinolin-4-yl)methanone

Systemtic Name: [4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]-(2-pyridin-4-ylquinolin-4-yl)methanone Openeye Name: [4-(2,3-dihydrobenzofuran-5-ylmethyl)piperazin-1-yl]-[2-(4-pyridyl)-4-quinolyl]methanone CAS Name: [4-(2,3-dihydrobenzofuran-5-ylmethyl)-1-piperazinyl]-(2-pyridin-4-yl-4-quinolinyl)methanone IUPAC Name: [4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]-(2-pyridin-4-ylquinolin-4-yl)methanone Traditional Name: [4-(coumaran-5-ylmethyl)piperazino]-[2-(4-pyridyl)-4-quinolyl]methanone Formula: C28H26N4O2 MolecularWeight: 450.53164

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C1C=C(C=C2)CN3CCN(CC3)C(=O)C4=CC(=NC5=CC=CC=C54)C6=CC=NC=C6

Isomeric SMILES

C1COC2=C1C=C(C=C2)CN3CCN(CC3)C(=O)C4=CC(=NC5=CC=CC=C54)C6=CC=NC=C6

InChI

InChI=1S/C28H26N4O2/c33-28(24-18-26(21-7-10-29-11-8-21)30-25-4-2-1-3-23(24)25)32-14-12-31(13-15-32)19-20-5-6-27-22(17-20)9-16-34-27/h1-8,10-11,17-18H,9,12-16,19H2