1-[4-[[2-(2,3-dihydro-1-benzofuran-5-yl)-1H-imidazol-5-yl]methyl]piperazin-1-yl]isoquinoline

Systemtic Name: 1-[4-[[2-(2,3-dihydro-1-benzofuran-5-yl)-1H-imidazol-5-yl]methyl]piperazin-1-yl]isoquinoline Openeye Name: 1-[4-[[2-(2,3-dihydrobenzofuran-5-yl)-1H-imidazol-5-yl]methyl]piperazin-1-yl]isoquinoline CAS Name: 1-[4-[[2-(2,3-dihydrobenzofuran-5-yl)-1H-imidazol-5-yl]methyl]-1-piperazinyl]isoquinoline IUPAC Name: 1-[4-[[2-(2,3-dihydro-1-benzofuran-5-yl)-1H-imidazol-5-yl]methyl]piperazin-1-yl]isoquinoline Traditional Name: 1-[4-[(2-coumaran-5-yl-1H-imidazol-5-yl)methyl]piperazino]isoquinoline Formula: C25H25N5O MolecularWeight: 411.4989

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C1C=C(C=C2)C3=NC=C(N3)CN4CCN(CC4)C5=NC=CC6=CC=CC=C65

Isomeric SMILES

C1COC2=C1C=C(C=C2)C3=NC=C(N3)CN4CCN(CC4)C5=NC=CC6=CC=CC=C65

InChI

InChI=1S/C25H25N5O/c1-2-4-22-18(3-1)7-9-26-25(22)30-12-10-29(11-13-30)17-21-16-27-24(28-21)20-5-6-23-19(15-20)8-14-31-23/h1-7,9,15-16H,8,10-14,17H2,(H,27,28)