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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C1C=C(C=C2)N3C=NC=C3CN4CCN(CC4)C5=NC=CC6=CC=CC=C65

Isomeric SMILES

C1COC2=C1C=C(C=C2)N3C=NC=C3CN4CCN(CC4)C5=NC=CC6=CC=CC=C65

InChI

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