[3-(phenoxymethyl)-1-benzofuran-2-yl]-[4-(pyridin-4-ylmethyl)piperazin-1-yl]methanone

Systemtic Name: [3-(phenoxymethyl)-1-benzofuran-2-yl]-[4-(pyridin-4-ylmethyl)piperazin-1-yl]methanone Openeye Name: [3-(phenoxymethyl)benzofuran-2-yl]-[4-(4-pyridylmethyl)piperazin-1-yl]methanone CAS Name: [3-(phenoxymethyl)-2-benzofuranyl]-[4-(pyridin-4-ylmethyl)-1-piperazinyl]methanone IUPAC Name: [3-(phenoxymethyl)-1-benzofuran-2-yl]-[4-(pyridin-4-ylmethyl)piperazin-1-yl]methanone Traditional Name: [3-(phenoxymethyl)benzofuran-2-yl]-[4-(4-pyridylmethyl)piperazino]methanone Formula: C26H25N3O3 MolecularWeight: 427.495

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=NC=C2)C(=O)C3=C(C4=CC=CC=C4O3)COC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CC2=CC=NC=C2)C(=O)C3=C(C4=CC=CC=C4O3)COC5=CC=CC=C5

InChI

InChI=1S/C26H25N3O3/c30-26(29-16-14-28(15-17-29)18-20-10-12-27-13-11-20)25-23(19-31-21-6-2-1-3-7-21)22-8-4-5-9-24(22)32-25/h1-13H,14-19H2