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

Systemtic Name: [4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]-(2-propan-2-ylquinolin-4-yl)methanone Openeye Name: [4-(2,3-dihydrobenzofuran-5-ylmethyl)piperazin-1-yl]-(2-isopropyl-4-quinolyl)methanone CAS Name: [4-(2,3-dihydrobenzofuran-5-ylmethyl)-1-piperazinyl]-(2-propan-2-yl-4-quinolinyl)methanone IUPAC Name: [4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]-(2-propan-2-ylquinolin-4-yl)methanone Traditional Name: [4-(coumaran-5-ylmethyl)piperazino]-(2-isopropyl-4-quinolyl)methanone Formula: C26H29N3O2 MolecularWeight: 415.52736

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC2=CC=CC=C2C(=C1)C(=O)N3CCN(CC3)CC4=CC5=C(C=C4)OCC5

Isomeric SMILES

CC(C)C1=NC2=CC=CC=C2C(=C1)C(=O)N3CCN(CC3)CC4=CC5=C(C=C4)OCC5

InChI

InChI=1S/C26H29N3O2/c1-18(2)24-16-22(21-5-3-4-6-23(21)27-24)26(30)29-12-10-28(11-13-29)17-19-7-8-25-20(15-19)9-14-31-25/h3-8,15-16,18H,9-14,17H2,1-2H3