N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-[(2S)-2-(6-methoxyquinolin-4-yl)-2-oxidanyl-ethyl]piperidine-4-carboxamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-[(2S)-2-(6-methoxyquinolin-4-yl)-2-oxidanyl-ethyl]piperidine-4-carboxamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-[(2S)-2-hydroxy-2-(6-methoxy-4-quinolyl)ethyl]piperidine-4-carboxamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-[(2S)-2-hydroxy-2-(6-methoxy-4-quinolinyl)ethyl]-4-piperidinecarboxamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-[(2S)-2-hydroxy-2-(6-methoxyquinolin-4-yl)ethyl]piperidine-4-carboxamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-[(2S)-2-hydroxy-2-(6-methoxy-4-quinolyl)ethyl]isonipecotamide Formula: C26H29N3O5 MolecularWeight: 463.52556

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=CN=C2C=C1)C(CN3CCC(CC3)C(=O)NC4=CC5=C(C=C4)OCCO5)O

Isomeric SMILES

COC1=CC2=C(C=CN=C2C=C1)[C@@H](CN3CCC(CC3)C(=O)NC4=CC5=C(C=C4)OCCO5)O

InChI

InChI=1S/C26H29N3O5/c1-32-19-3-4-22-21(15-19)20(6-9-27-22)23(30)16-29-10-7-17(8-11-29)26(31)28-18-2-5-24-25(14-18)34-13-12-33-24/h2-6,9,14-15,17,23,30H,7-8,10-13,16H2,1H3,(H,28,31)/t23-/m1/s1