1-[(2S)-3-(1-benzofuran-4-yloxy)-2-oxidanyl-propyl]-4-quinolin-3-yl-piperidin-4-ol

Systemtic Name: 1-[(2S)-3-(1-benzofuran-4-yloxy)-2-oxidanyl-propyl]-4-quinolin-3-yl-piperidin-4-ol Openeye Name: 1-[(2S)-3-(benzofuran-4-yloxy)-2-hydroxy-propyl]-4-(3-quinolyl)piperidin-4-ol CAS Name: 1-[(2S)-3-(4-benzofuranyloxy)-2-hydroxypropyl]-4-(3-quinolinyl)-4-piperidinol IUPAC Name: 1-[(2S)-3-(1-benzofuran-4-yloxy)-2-hydroxypropyl]-4-quinolin-3-ylpiperidin-4-ol Traditional Name: 1-[(2S)-3-(benzofuran-4-yloxy)-2-hydroxy-propyl]-4-(3-quinolyl)piperidin-4-ol Formula: C25H26N2O4 MolecularWeight: 418.48494

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C2=CC3=CC=CC=C3N=C2)O)CC(COC4=CC=CC5=C4C=CO5)O

Isomeric SMILES

C1CN(CCC1(C2=CC3=CC=CC=C3N=C2)O)C[C@@H](COC4=CC=CC5=C4C=CO5)O

InChI

InChI=1S/C25H26N2O4/c28-20(17-31-24-7-3-6-23-21(24)8-13-30-23)16-27-11-9-25(29,10-12-27)19-14-18-4-1-2-5-22(18)26-15-19/h1-8,13-15,20,28-29H,9-12,16-17H2/t20-/m0/s1